A0A5K4F0P1_SCHMA Loading...

Centrosomal protein of 162 kDa

AlphaFold DB , UniProt , Accession A0A5K4F0P1, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 929 aa.

						>A0A5K4F0P1_SCHMA|A0A5K4F0P1
MNNEMIDFNEKFNQLKQFNHSDILLSKINNDQESINQIEQLLYQVLNENSMLREKNEELEEMLLNKEDHSKKLNMILKDIKMELNKKEEMNEQLKSDNMILNNLIQSMKTEQEMFHLDKENLIRTNKHLEQIILTKIENEKKLLEDNQILDELIQDLREQLTVYTMSKTRSNESNDLEDDLHHPPHHPIGHKCSNCDYLQKQLQAYIYLYGELIDPNVQDNTDNCSFEELTEKSKRNIPSDKICTKLNQPIKITDTNNQSNEKVNPNETLIKSHSDYSSSSESSLINECVTNHNKSHGAKYMRRNESLIESKYTGRLGSSDDSQSNKFNNDFLSKWSSIQHENEQLKCQLNEMNSFWEEKQKKLEDHCRLLSARLKYMKSKHSSVQHHKISWLKSSLNILVPLKKLKYHSRRKFKLNYRTKREIQQDFNHLSDCNQCQDVEGPRKNDNQLMTLNHDDNNQSDATSSELIMKQNLNNEPKLKLINNYKTSLIKSRKRAIQLLKAHNKLPHLTEIQCSYELLSQRNNSLLQQITAEQSNQELNNLVESLSSMLHRSRKQNIQAKRTIESIKMHLIKLQDTIKQLNMENNQITTVHQSENNTSSTLDNMNSKKFIKEFSDDIIHQLQEAINRKRIEHINMKNKIITLENETKRRRHYIEELRIRLQCVLAEQTDLRNDLLTKQKMNETLKLSEVQLKQTKQSQHIQLITLMNEKKNILENFHLLKQSHNHLMNELNQLKGNFLNLQKSKNENNDRIDHLEKFILILANELIKTIKTIYQLRNHSSMITHTINKKSELSSNYAISNDGNSKPSISQDSLQLAKMKAAEILCLSLNDLEKLTFLDQNSCHSDKQDVNIDNDIEDDDRVEEVNSFNDGTKHRNEHEKLSKSTIQSYLNNLSKWPIHCERLLKDLTEEFSMKLNDLIDIVSIFFCK
					

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	47.8	Very low	60.5	Low	154 Å²	154	121.7 Å²	121.7	76%	0.759	60%	0.601	S	S	*	*				0	-77.5	0	-75.1	178.4	-171.5	0	0	112.2	N3 E4 M5	M1-N3 VanDerWaalsContact C-N 3.34Å; M1-N3 PolarHBondContact O-N 3.15Å; M1-E4 VanDerWaalsContact CA-OE2 3.25Å; M1-E4 WeakPolarHBondContact CA-OE2 3.49Å; M1-E4 PolarHBondContact N-OE2 3.45Å; M1-E4 PolarHBondContact O-N 2.67Å; M1-E4 VanDerWaalsContact O-N 3.08Å; M1-M5 PolarHBondContact O-N 3.35Å
2	N	51.7	Low	60.9	Low	130 Å²	130	121.3 Å²	121.3	70%	0.695	59%	0.593	S	S	*	*	H	α-helix	trans	-53.7	-43.7	-174.7	-83.9	20.6	0	0	0	114.5	M5 I6	N2-M5 PolarHBondContact O-N 3.05Å; N2-I6 WeakPolarHBondContact O-CG1 3.32Å; N2-I6 PolarHBondContact O-N 2.95Å
3	N	56.2	Low	61.3	Low	136 Å²	136	118.2 Å²	118.2	73%	0.727	58%	0.581	S	S	*	*	H	α-helix	trans	-71.2	-31.7	-179.7	-64.7	10.6	0	0	0	113.2	M1 D7	M1-N3 VanDerWaalsContact C-N 3.34Å; M1-N3 PolarHBondContact O-N 3.15Å; N3-D7 PolarHBondContact O-N 3.17Å
4	E	54.3	Low	61.5	Low	135 Å²	135	117.6 Å²	117.6	63%	0.631	58%	0.576	S	S	*	*	H	α-helix	trans	-75.3	-33.3	176.9	-65.3	151.5	140.5	0	0	111.3	M1 I6 D7 F8	M1-E4 VanDerWaalsContact CA-OE2 3.25Å; M1-E4 WeakPolarHBondContact CA-OE2 3.49Å; M1-E4 PolarHBondContact N-OE2 3.45Å; M1-E4 PolarHBondContact O-N 2.67Å; M1-E4 VanDerWaalsContact O-N 3.08Å; E4-I6 VanDerWaalsContact C-N 3.3Å; E4-I6 PolarHBondContact O-N 2.98Å; E4-D7 PolarHBondContact O-N 3.3Å; E4-F8 WeakPolarHBondContact O-CB 3.5Å; E4-F8 PolarHBondContact O-N 3.21Å; E4-F8 VanDerWaalsContact O-N 3.08Å
5	M	55.4	Low	61.2	Low	146 Å²	146	116.1 Å²	116.1	72%	0.719	57%	0.571	S	S	*	*	H	α-helix	trans	-69.7	-28.7	177.8	-151.5	177.7	-161.7	0	0	112.1	M1 N2 N9	M1-M5 PolarHBondContact O-N 3.35Å; N2-M5 PolarHBondContact O-N 3.05Å; M5-N9 VanDerWaalsContact O-CB 3.26Å; M5-N9 WeakPolarHBondContact O-CB 3.21Å; M5-N9 PolarHBondContact O-N 2.9Å; M5-N9 VanDerWaalsContact O-N 3.15Å
6	I	66.4	Low	60.8	Low	112 Å²	112	115.7 Å²	115.7	57%	0.574	57%	0.565	S	S	*	*	H	α-helix	trans	-68.6	-51.9	173.7	-68.1	164.3	0	0	0	110.4	N2 E4 F8 N9 E10	N2-I6 WeakPolarHBondContact O-CG1 3.32Å; N2-I6 PolarHBondContact O-N 2.95Å; E4-I6 VanDerWaalsContact C-N 3.3Å; E4-I6 PolarHBondContact O-N 2.98Å; I6-F8 VanDerWaalsContact C-N 3.29Å; I6-F8 PolarHBondContact O-N 3.45Å; I6-N9 PolarHBondContact O-N 3.02Å; I6-N9 VanDerWaalsContact O-N 3.14Å; I6-E10 PolarHBondContact O-N 3.33Å
7	D	66.7	Low	60.4	Low	80 Å²	80	117.5 Å²	117.5	43%	0.428	57%	0.572	S	S	.	*	H	α-helix	trans	-61.6	-35.2	-179.8	-171.9	64.4	0	0	0	112.5	N3 E4 K11	N3-D7 PolarHBondContact O-N 3.17Å; E4-D7 PolarHBondContact O-N 3.3Å; D7-K11 PolarHBondContact O-N 2.99Å; D7-K11 IonicContact OD1-NZ 3.28Å; D7-K11 IonicContact OD2-NZ 2.67Å; D7-K11 PolarHBondContact OD2-NZ 3.31Å
8	F	61	Low	59.9	Low	129 Å²	129	119.9 Å²	119.9	57%	0.566	58%	0.579	S	S	*	*	H	α-helix	trans	-70	-40.3	174.7	-146.9	-85	0	0	0	112.5	E4 I6 F12	E4-F8 WeakPolarHBondContact O-CB 3.5Å; E4-F8 PolarHBondContact O-N 3.21Å; E4-F8 VanDerWaalsContact O-N 3.08Å; I6-F8 VanDerWaalsContact C-N 3.29Å; I6-F8 PolarHBondContact O-N 3.45Å; F8-F12 WeakPolarHBondContact O-CB 3.47Å; F8-F12 PolarHBondContact O-N 3.28Å
9	N	68.4	Low	59.4	Low	93 Å²	93	120.7 Å²	120.7	50%	0.497	59%	0.587	S	S	.	*	H	α-helix	trans	-72.6	-29.8	179.6	-159.1	24.3	0	0	0	111.7	M5 I6 N13	M5-N9 VanDerWaalsContact O-CB 3.26Å; M5-N9 WeakPolarHBondContact O-CB 3.21Å; M5-N9 PolarHBondContact O-N 2.9Å; M5-N9 VanDerWaalsContact O-N 3.15Å; I6-N9 PolarHBondContact O-N 3.02Å; I6-N9 VanDerWaalsContact O-N 3.14Å; N9-N13 WeakPolarHBondContact O-CB 3.47Å; N9-N13 PolarHBondContact O-N 3.31Å; N9-N13 PolarHBondContact O-ND2 2.89Å
10	E	70.8	Confident	58.7	Low	115 Å²	115	122.1 Å²	122.1	54%	0.537	59%	0.592	S	S	.	*	H	α-helix	trans	-67.4	-46.4	173.9	-163.6	162.3	-147.3	0	0	111.3	I6 N13 Q14	I6-E10 PolarHBondContact O-N 3.33Å; E10-N13 PolarHBondContact O-N 3.24Å; E10-Q14 WeakPolarHBondContact O-CG 3.23Å; E10-Q14 PolarHBondContact O-N 3.32Å; E10-Q14 VanDerWaalsContact O-N 3.08Å
11	K	66.3	Low	57.9	Low	109 Å²	109	119.6 Å²	119.6	47%	0.474	59%	0.587	S	S	.	*	H	α-helix	trans	-63.3	-39.7	172.7	-73	166	-177.5	155.1	0	112.9	D7 N13 Q14 L15	D7-K11 PolarHBondContact O-N 2.99Å; D7-K11 IonicContact OD1-NZ 3.28Å; D7-K11 IonicContact OD2-NZ 2.67Å; D7-K11 PolarHBondContact OD2-NZ 3.31Å; K11-N13 PolarHBondContact O-N 3.43Å; K11-Q14 PolarHBondContact O-N 3.33Å; K11-L15 PolarHBondContact O-N 2.91Å; K11-L15 VanDerWaalsContact O-N 3.08Å
12	F	66.1	Low	57.6	Low	117 Å²	117	119.8 Å²	119.8	51%	0.513	59%	0.591	S	S	.	*	H	α-helix	trans	-64.7	-38	176.1	-170	-98.9	0	0	0	112.3	F8 L15 K16	F8-F12 WeakPolarHBondContact O-CB 3.47Å; F8-F12 PolarHBondContact O-N 3.28Å; F12-L15 PolarHBondContact O-N 2.91Å; F12-K16 PolarHBondContact O-N 3.39Å
13	N	65.9	Low	57.3	Low	80 Å²	80	120 Å²	120	43%	0.428	59%	0.59	S	S	.	*	H	α-helix	trans	-69.5	-32.6	174.8	-76.9	-52.5	0	0	0	112.9	N9 E10 K11 K16 Q17	N9-N13 WeakPolarHBondContact O-CB 3.47Å; N9-N13 PolarHBondContact O-N 3.31Å; N9-N13 PolarHBondContact O-ND2 2.89Å; E10-N13 PolarHBondContact O-N 3.24Å; K11-N13 PolarHBondContact O-N 3.43Å; N13-K16 PolarHBondContact O-N 3.4Å; N13-Q17 PolarHBondContact O-N 2.86Å
14	Q	64.4	Low	56.5	Low	110 Å²	110	120.4 Å²	120.4	51%	0.514	59%	0.592	S	S	.	*	H	α-helix	trans	-63.4	-45.4	170.8	-69.5	172.7	12.6	0	0	111.4	E10 K11 K16 Q17	E10-Q14 WeakPolarHBondContact O-CG 3.23Å; E10-Q14 PolarHBondContact O-N 3.32Å; E10-Q14 VanDerWaalsContact O-N 3.08Å; K11-Q14 PolarHBondContact O-N 3.33Å; Q14-K16 VanDerWaalsContact C-N 3.26Å; Q14-K16 PolarHBondContact O-N 3.38Å; Q14-Q17 WeakPolarHBondContact O-CB 3.38Å; Q14-Q17 PolarHBondContact O-N 3.15Å; Q14-Q17 VanDerWaalsContact O-N 3.12Å
15	L	55.9	Low	56.1	Low	95 Å²	95	119.6 Å²	119.6	50%	0.497	59%	0.592	S	S	.	*	H	α-helix	trans	-59.5	-35.3	172.3	-99.2	138.6	0	0	0	112.8	K11 F12 Q17 F18 N19	K11-L15 PolarHBondContact O-N 2.91Å; K11-L15 VanDerWaalsContact O-N 3.08Å; F12-L15 PolarHBondContact O-N 2.91Å; L15-Q17 VanDerWaalsContact C-N 3.29Å; L15-Q17 PolarHBondContact O-N 3.43Å; L15-F18 PolarHBondContact O-N 2.82Å; L15-N19 PolarHBondContact O-N 3.18Å
16	K	54.8	Low	55.7	Low	110 Å²	110	117.4 Å²	117.4	48%	0.478	59%	0.59	S	S	.	*	H	α-helix	trans	-68.8	-24	177.1	-155	175.2	-176.2	-178.1	0	113.6	F12 N13 Q14	F12-K16 PolarHBondContact O-N 3.39Å; N13-K16 PolarHBondContact O-N 3.4Å; Q14-K16 VanDerWaalsContact C-N 3.26Å; Q14-K16 PolarHBondContact O-N 3.38Å
17	Q	54.1	Low	54.9	Low	147 Å²	147	121.1 Å²	121.1	69%	0.687	60%	0.602	S	S	*	*	H	α-helix	trans	-72.3	-33.5	171.6	-68.9	-179.9	-4.4	0	0	112.2	N13 Q14 L15 H20 S21	N13-Q17 PolarHBondContact O-N 2.86Å; Q14-Q17 WeakPolarHBondContact O-CB 3.38Å; Q14-Q17 PolarHBondContact O-N 3.15Å; Q14-Q17 VanDerWaalsContact O-N 3.12Å; L15-Q17 VanDerWaalsContact C-N 3.29Å; L15-Q17 PolarHBondContact O-N 3.43Å; Q17-H20 PolarHBondContact O-N 3.17Å; Q17-S21 PolarHBondContact O-N 3.46Å; Q17-S21 PolarHBondContact O-OG 3.42Å; Q17-S21 VanDerWaalsContact O-OG 3.11Å
18	F	51.9	Low	54	Low	160 Å²	160	121 Å²	121	70%	0.702	60%	0.601	S	S	*	*	H	α-helix	trans	-65.3	-40.5	172.5	-82.4	-85.6	0	0	0	112.1	L15 H20 S21	L15-F18 PolarHBondContact O-N 2.82Å; F18-H20 PolarHBondContact O-N 3.01Å; F18-S21 PolarHBondContact O-N 2.87Å
19	N	50.6	Low	53.4	Low	135 Å²	135	120.1 Å²	120.1	72%	0.722	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.9	-4.1	178.1	-79.3	-18.7	0	0	0	115.5	L15	L15-N19 PolarHBondContact O-N 3.18Å
20	H	44.6	Very low	52.6	Low	149 Å²	149	123.1 Å²	123.1	69%	0.69	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-120.6	15.6	174.4	-70.1	-33.1	0	0	0	112.9	Q17 F18	Q17-H20 PolarHBondContact O-N 3.17Å; F18-H20 PolarHBondContact O-N 3.01Å
21	S	42	Very low	52.1	Low	69 Å²	69	121.8 Å²	121.8	48%	0.483	62%	0.615	S	S	.	*	S	Bend	trans	-82.8	114.3	166.9	-62.4	0	0	0	0	109	Q17 F18 I23	Q17-S21 PolarHBondContact O-N 3.46Å; Q17-S21 PolarHBondContact O-OG 3.42Å; Q17-S21 VanDerWaalsContact O-OG 3.11Å; F18-S21 PolarHBondContact O-N 2.87Å; S21-I23 PolarHBondContact O-N 3.4Å
22	D	42.2	Very low	52.1	Low	159 Å²	159	122.4 Å²	122.4	85%	0.85	62%	0.619	S	S	*	*			trans	-65.7	82.4	172.6	-77.2	-43.1	0	0	0	110.4	L24	D22-L24 VanDerWaalsContact C-N 3.31Å; D22-L24 PolarHBondContact O-N 2.89Å
23	I	44.9	Very low	52.2	Low	133 Å²	133	123.5 Å²	123.5	68%	0.682	63%	0.626	S	S	*	*			trans	-70.8	92.9	171.1	-59.9	179	0	0	0	107.6	S21 L25	S21-I23 PolarHBondContact O-N 3.4Å; I23-L25 VanDerWaalsContact C-N 3.26Å; I23-L25 HydrophobicContact CG2-CG 4.48Å; I23-L25 PolarHBondContact O-N 3Å
24	L	40	Very low	52	Low	145 Å²	145	121.5 Å²	121.5	76%	0.759	62%	0.619	S	S	*	*			trans	-60.5	85.2	170.9	-87.4	160.2	0	0	0	110.6	D22 S26	D22-L24 VanDerWaalsContact C-N 3.31Å; D22-L24 PolarHBondContact O-N 2.89Å; L24-S26 PolarHBondContact O-N 2.88Å
25	L	46.5	Very low	52.1	Low	119 Å²	119	119.3 Å²	119.3	62%	0.623	61%	0.61	S	S	*	*			trans	-63.7	5.7	177	-98	145.1	0	0	0	114.7	I23 K27 I28	I23-L25 VanDerWaalsContact C-N 3.26Å; I23-L25 HydrophobicContact CG2-CG 4.48Å; I23-L25 PolarHBondContact O-N 3Å; L25-K27 PolarHBondContact O-N 2.89Å; L25-K27 VanDerWaalsContact O-N 3.15Å; L25-I28 HydrophobicContact CD2-CD1 3.44Å; L25-I28 VanDerWaalsContact CD2-CD1 3.44Å; L25-I28 HydrophobicContact CD2-CG1 4.15Å; L25-I28 HydrophobicContact CG-CD1 4.45Å
26	S	46.8	Very low	52.8	Low	99 Å²	99	118.3 Å²	118.3	69%	0.692	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.8	14.7	-174.2	56.5	0	0	0	0	115.4	L24	L24-S26 PolarHBondContact O-N 2.88Å
27	K	48.2	Very low	53.5	Low	190 Å²	190	118.1 Å²	118.1	83%	0.826	61%	0.606	S	S	*	*	T	Hydrogen-bonded Turn	trans	-138.7	15.3	-176.8	-87.1	-168.7	175.1	-177.8	0	115.7	L25 N29	L25-K27 PolarHBondContact O-N 2.89Å; L25-K27 VanDerWaalsContact O-N 3.15Å; K27-N29 PolarHBondContact O-N 2.97Å
28	I	47.7	Very low	54.1	Low	78 Å²	78	114.4 Å²	114.4	40%	0.4	59%	0.59	S	S	.	*			trans	-79.3	109.7	178.9	-54.8	-157.4	0	0	0	109.5	L25 I38	L25-I28 HydrophobicContact CD2-CD1 3.44Å; L25-I28 VanDerWaalsContact CD2-CD1 3.44Å; L25-I28 HydrophobicContact CD2-CG1 4.15Å; L25-I28 HydrophobicContact CG-CD1 4.45Å; I28-I38 HydrophobicContact CD1-CD1 3.6Å
29	N	48.7	Very low	55	Low	110 Å²	110	112 Å²	112	59%	0.588	58%	0.581	S	S	*	*			trans	-57.6	150.5	165.4	-81.2	-11.5	0	0	0	109.7	K27 D31	K27-N29 PolarHBondContact O-N 2.97Å; N29-D31 HydrophobicContact CB-CB 4.44Å; N29-D31 WeakPolarHBondContact CB-OD2 3.38Å; N29-D31 PolarHBondContact ND2-OD2 2.87Å; N29-D31 PolarHBondContact O-N 3.3Å
30	N	53	Low	56.1	Low	157 Å²	157	112.4 Å²	112.4	84%	0.84	58%	0.578	S	S	*	*	S	Bend	trans	-71.3	36.5	174.1	-74.4	-26.7	0	0	0	113.3	Q32	N30-Q32 PolarHBondContact O-N 3.43Å
31	D	59.5	Low	57.3	Low	86 Å²	86	110.5 Å²	110.5	46%	0.46	57%	0.572	S	S	.	*			trans	-80.5	114.8	178.1	-59	-25.4	0	0	0	107.2	N29 E33 S34 I35	N29-D31 HydrophobicContact CB-CB 4.44Å; N29-D31 WeakPolarHBondContact CB-OD2 3.38Å; N29-D31 PolarHBondContact ND2-OD2 2.87Å; N29-D31 PolarHBondContact O-N 3.3Å; D31-E33 PolarHBondContact O-N 2.7Å; D31-S34 WeakPolarHBondContact O-CB 3.16Å; D31-S34 PolarHBondContact O-N 2.9Å; D31-I35 PolarHBondContact O-N 3.49Å
32	Q	66.2	Low	58.7	Low	123 Å²	123	111.9 Å²	111.9	58%	0.575	57%	0.574	S	S	*	*	H	α-helix	trans	-50.9	-30.5	-174.6	-173.6	66.3	46.3	0	0	113.1	N30 I35 N36	N30-Q32 PolarHBondContact O-N 3.43Å; Q32-I35 PolarHBondContact O-N 3.41Å; Q32-N36 PolarHBondContact NE2-OD1 2.9Å; Q32-N36 WeakPolarHBondContact O-CB 3.39Å; Q32-N36 PolarHBondContact O-N 3.01Å; Q32-N36 PolarHBondContact O-OD1 3.46Å
33	E	69.3	Low	60.2	Low	139 Å²	139	113 Å²	113	65%	0.65	57%	0.568	S	S	*	*	H	α-helix	trans	-62.7	-39.2	175.5	-170.3	169.3	-163.8	0	0	112.9	D31 N36 Q37	D31-E33 PolarHBondContact O-N 2.7Å; E33-N36 PolarHBondContact O-N 3Å; E33-Q37 WeakPolarHBondContact O-CG 3.48Å; E33-Q37 PolarHBondContact O-N 2.92Å
34	S	61.7	Low	61.4	Low	39 Å²	39	111.9 Å²	111.9	27%	0.273	56%	0.56	S	S	.	*	H	α-helix	trans	-67.2	-39.3	175.5	-62.7	0	0	0	0	111.6	D31 Q37 I38	D31-S34 WeakPolarHBondContact O-CB 3.16Å; D31-S34 PolarHBondContact O-N 2.9Å; S34-Q37 PolarHBondContact O-N 3.42Å; S34-I38 WeakPolarHBondContact O-CD1 3.27Å; S34-I38 VanDerWaalsContact O-CG1 3.28Å; S34-I38 WeakPolarHBondContact O-CG1 3.49Å; S34-I38 PolarHBondContact O-N 2.89Å
35	I	65	Low	62.7	Low	64 Å²	64	108.7 Å²	108.7	33%	0.328	55%	0.546	S	S	.	.	H	α-helix	trans	-64.9	-47.4	176.3	-62.2	176	0	0	0	109.9	D31 Q32 Q37 I38 E39	D31-I35 PolarHBondContact O-N 3.49Å; Q32-I35 PolarHBondContact O-N 3.41Å; I35-Q37 VanDerWaalsContact C-N 3.33Å; I35-Q37 PolarHBondContact O-N 3.49Å; I35-I38 PolarHBondContact O-N 3.5Å; I35-E39 PolarHBondContact O-N 3Å
36	N	71.6	Confident	63.9	Low	74 Å²	74	107.7 Å²	107.7	40%	0.396	54%	0.54	S	S	.	.	H	α-helix	trans	-61.6	-38	178.1	-67.7	0.7	0	0	0	112.3	Q32 E33 E39 Q40	Q32-N36 PolarHBondContact NE2-OD1 2.9Å; Q32-N36 WeakPolarHBondContact O-CB 3.39Å; Q32-N36 PolarHBondContact O-N 3.01Å; Q32-N36 PolarHBondContact O-OD1 3.46Å; E33-N36 PolarHBondContact O-N 3Å; N36-E39 PolarHBondContact O-N 3.18Å; N36-Q40 WeakPolarHBondContact O-CG 3.4Å; N36-Q40 PolarHBondContact O-N 3.41Å
37	Q	69.2	Low	65.3	Low	106 Å²	106	108.1 Å²	108.1	50%	0.495	54%	0.535	S	S	.	.	H	α-helix	trans	-65.8	-41.1	174.7	-75.1	177.1	18.1	0	0	112	E33 S34 I35 Q40 L41	E33-Q37 WeakPolarHBondContact O-CG 3.48Å; E33-Q37 PolarHBondContact O-N 2.92Å; S34-Q37 PolarHBondContact O-N 3.42Å; I35-Q37 VanDerWaalsContact C-N 3.33Å; I35-Q37 PolarHBondContact O-N 3.49Å; Q37-Q40 PolarHBondContact O-N 3.3Å; Q37-L41 WeakPolarHBondContact O-CG 3.5Å; Q37-L41 PolarHBondContact O-N 2.99Å
38	I	66.7	Low	66.4	Low	68 Å²	68	103.2 Å²	103.2	35%	0.349	52%	0.515	S	S	.	.	H	α-helix	trans	-64.3	-44	175.4	-69	164.3	0	0	0	110.7	I28 S34 I35 L41 L42	I28-I38 HydrophobicContact CD1-CD1 3.6Å; S34-I38 WeakPolarHBondContact O-CD1 3.27Å; S34-I38 VanDerWaalsContact O-CG1 3.28Å; S34-I38 WeakPolarHBondContact O-CG1 3.49Å; S34-I38 PolarHBondContact O-N 2.89Å; I35-I38 PolarHBondContact O-N 3.5Å; I38-L41 PolarHBondContact O-N 3.05Å; I38-L42 HydrophobicContact CG2-CD1 4.27Å; I38-L42 WeakPolarHBondContact O-CB 3.34Å; I38-L42 PolarHBondContact O-N 3.17Å
39	E	70.8	Confident	67.4	Low	111 Å²	111	103 Å²	103	52%	0.519	52%	0.515	S	S	.	.	H	α-helix	trans	-62.3	-41.2	176.1	-74.1	-170.6	159	0	0	112.4	I35 N36 L42 Y43	I35-E39 PolarHBondContact O-N 3Å; N36-E39 PolarHBondContact O-N 3.18Å; E39-L42 PolarHBondContact O-N 3.41Å; E39-Y43 WeakPolarHBondContact O-CB 3.37Å; E39-Y43 PolarHBondContact O-N 3.33Å
40	Q	73	Confident	68.7	Low	143 Å²	143	100.4 Å²	100.4	67%	0.668	51%	0.505	S	S	*	.	H	α-helix	trans	-62.4	-45.2	174.6	-78.4	-175.9	-6.9	0	0	112.2	N36 Q37 L42 Y43 Q44	N36-Q40 WeakPolarHBondContact O-CG 3.4Å; N36-Q40 PolarHBondContact O-N 3.41Å; Q37-Q40 PolarHBondContact O-N 3.3Å; Q40-L42 VanDerWaalsContact C-N 3.34Å; Q40-L42 PolarHBondContact O-N 3.13Å; Q40-Y43 PolarHBondContact O-N 3.38Å; Q40-Q44 WeakPolarHBondContact O-CB 3.22Å; Q40-Q44 PolarHBondContact O-N 3.2Å
41	L	70.2	Confident	69.7	Low	108 Å²	108	98.3 Å²	98.3	57%	0.565	49%	0.492	S	S	*	.	H	α-helix	trans	-62.8	-40.3	175.7	-73.1	168.7	0	0	0	111.6	Q37 I38 Q44 V45	Q37-L41 WeakPolarHBondContact O-CG 3.5Å; Q37-L41 PolarHBondContact O-N 2.99Å; I38-L41 PolarHBondContact O-N 3.05Å; L41-Q44 PolarHBondContact O-N 3.02Å; L41-V45 WeakPolarHBondContact O-CB 3.44Å; L41-V45 VanDerWaalsContact O-CG2 3.29Å; L41-V45 WeakPolarHBondContact O-CG2 3.42Å; L41-V45 PolarHBondContact O-N 3.29Å
42	L	70.9	Confident	70.3	Confident	98 Å²	98	98.1 Å²	98.1	51%	0.513	49%	0.49	S	S	.	.	H	α-helix	trans	-64	-44	175.6	-115.9	150.5	0	0	0	112	I38 E39 Q40 V45 L46	I38-L42 HydrophobicContact CG2-CD1 4.27Å; I38-L42 WeakPolarHBondContact O-CB 3.34Å; I38-L42 PolarHBondContact O-N 3.17Å; E39-L42 PolarHBondContact O-N 3.41Å; Q40-L42 VanDerWaalsContact C-N 3.34Å; Q40-L42 PolarHBondContact O-N 3.13Å; L42-V45 PolarHBondContact O-N 2.8Å; L42-L46 HydrophobicContact CD2-CD1 4.06Å; L42-L46 HydrophobicContact CD2-CG 4.4Å; L42-L46 VanDerWaalsContact O-CB 3.31Å; L42-L46 WeakPolarHBondContact O-CB 3.35Å; L42-L46 WeakPolarHBondContact O-CG 3.49Å; L42-L46 PolarHBondContact O-N 2.88Å
43	Y	73.6	Confident	70.7	Confident	183 Å²	183	98.7 Å²	98.7	72%	0.718	49%	0.487	S	S	*	.	H	α-helix	trans	-61.8	-42.8	174.2	-102	-78.7	0	0	0	112.2	E39 Q40 L46 N47	E39-Y43 WeakPolarHBondContact O-CB 3.37Å; E39-Y43 PolarHBondContact O-N 3.33Å; Q40-Y43 PolarHBondContact O-N 3.38Å; Y43-L46 PolarHBondContact O-N 2.86Å; Y43-N47 WeakPolarHBondContact O-CB 3.3Å; Y43-N47 PolarHBondContact O-N 3.03Å
44	Q	70.3	Confident	71	Confident	110 Å²	110	98 Å²	98	51%	0.514	48%	0.484	S	S	.	.	H	α-helix	trans	-63.8	-48.5	178.1	-174	173.2	-12.2	0	0	111.2	Q40 L41 L46 N47 E48	Q40-Q44 WeakPolarHBondContact O-CB 3.22Å; Q40-Q44 PolarHBondContact O-N 3.2Å; L41-Q44 PolarHBondContact O-N 3.02Å; Q44-L46 VanDerWaalsContact C-N 3.34Å; Q44-L46 PolarHBondContact O-N 2.83Å; Q44-N47 PolarHBondContact O-N 2.97Å; Q44-E48 WeakPolarHBondContact CG-OE1 3.4Å; Q44-E48 PolarHBondContact NE2-OE1 2.99Å; Q44-E48 WeakPolarHBondContact O-CB 3.22Å; Q44-E48 WeakPolarHBondContact O-CG 3.29Å; Q44-E48 PolarHBondContact O-N 3.45Å
45	V	67.3	Low	71.7	Confident	77 Å²	77	101.9 Å²	101.9	47%	0.467	50%	0.496	S	S	.	.	H	α-helix	trans	-63.1	-37.1	177.2	170.1	0	0	0	0	112.1	L41 L42 N49	L41-V45 WeakPolarHBondContact O-CB 3.44Å; L41-V45 VanDerWaalsContact O-CG2 3.29Å; L41-V45 WeakPolarHBondContact O-CG2 3.42Å; L41-V45 PolarHBondContact O-N 3.29Å; L42-V45 PolarHBondContact O-N 2.8Å; V45-N49 WeakPolarHBondContact CG1-ND2 3.48Å; V45-N49 VanDerWaalsContact O-CB 3.32Å; V45-N49 WeakPolarHBondContact O-CB 3.25Å; V45-N49 PolarHBondContact O-N 3.21Å; V45-N49 PolarHBondContact O-ND2 3.42Å
46	L	72.1	Confident	72.1	Confident	98 Å²	98	102.8 Å²	102.8	51%	0.513	50%	0.501	S	S	.	.	H	α-helix	trans	-68	-39.8	175.6	-75.9	169.6	0	0	0	112.1	L42 Y43 Q44 S50	L42-L46 HydrophobicContact CD2-CD1 4.06Å; L42-L46 HydrophobicContact CD2-CG 4.4Å; L42-L46 VanDerWaalsContact O-CB 3.31Å; L42-L46 WeakPolarHBondContact O-CB 3.35Å; L42-L46 WeakPolarHBondContact O-CG 3.49Å; L42-L46 PolarHBondContact O-N 2.88Å; Y43-L46 PolarHBondContact O-N 2.86Å; Q44-L46 VanDerWaalsContact C-N 3.34Å; Q44-L46 PolarHBondContact O-N 2.83Å; L46-S50 PolarHBondContact O-N 2.93Å
47	N	75.7	Confident	72.3	Confident	108 Å²	108	105.6 Å²	105.6	58%	0.578	51%	0.512	S	S	*	.	H	α-helix	trans	-69.8	-43.9	178.2	-165	36.7	0	0	0	111.7	Y43 Q44 N49 S50 M51	Y43-N47 WeakPolarHBondContact O-CB 3.3Å; Y43-N47 PolarHBondContact O-N 3.03Å; Q44-N47 PolarHBondContact O-N 2.97Å; N47-N49 PolarHBondContact O-N 3.48Å; N47-S50 WeakPolarHBondContact O-CB 3.42Å; N47-S50 PolarHBondContact O-N 3.38Å; N47-S50 VanDerWaalsContact O-N 3.07Å; N47-M51 PolarHBondContact O-N 3.34Å
48	E	71.2	Confident	72.5	Confident	87 Å²	87	106 Å²	106	41%	0.407	51%	0.514	S	S	.	.	H	α-helix	trans	-60.7	-43.6	173.8	-73.4	176.1	-165.2	0	0	111.5	Q44 S50 M51 L52	Q44-E48 WeakPolarHBondContact CG-OE1 3.4Å; Q44-E48 PolarHBondContact NE2-OE1 2.99Å; Q44-E48 WeakPolarHBondContact O-CB 3.22Å; Q44-E48 WeakPolarHBondContact O-CG 3.29Å; Q44-E48 PolarHBondContact O-N 3.45Å; E48-S50 VanDerWaalsContact C-N 3.27Å; E48-S50 PolarHBondContact O-N 2.95Å; E48-M51 PolarHBondContact O-N 2.97Å; E48-L52 WeakPolarHBondContact O-CB 3.18Å; E48-L52 VanDerWaalsContact O-CG 3.31Å; E48-L52 WeakPolarHBondContact O-CG 3.4Å; E48-L52 PolarHBondContact O-N 3.41Å
49	N	70.4	Confident	72.6	Confident	74 Å²	74	107.1 Å²	107.1	40%	0.396	52%	0.52	S	S	.	.	H	α-helix	trans	-63.8	-29.6	172.9	-84.1	-64.2	0	0	0	113.3	V45 N47 R53	V45-N49 WeakPolarHBondContact CG1-ND2 3.48Å; V45-N49 VanDerWaalsContact O-CB 3.32Å; V45-N49 WeakPolarHBondContact O-CB 3.25Å; V45-N49 PolarHBondContact O-N 3.21Å; V45-N49 PolarHBondContact O-ND2 3.42Å; N47-N49 PolarHBondContact O-N 3.48Å; N49-R53 WeakPolarHBondContact O-CG 3.27Å; N49-R53 PolarHBondContact O-N 3.47Å; N49-R53 VanDerWaalsContact O-N 3.12Å
50	S	74.6	Confident	72.6	Confident	56 Å²	56	107.6 Å²	107.6	39%	0.392	52%	0.522	S	S	.	.	H	α-helix	trans	-69.5	-48	174.8	-151.5	0	0	0	0	111.5	L46 N47 E48 L52 R53 E54	L46-S50 PolarHBondContact O-N 2.93Å; N47-S50 WeakPolarHBondContact O-CB 3.42Å; N47-S50 PolarHBondContact O-N 3.38Å; N47-S50 VanDerWaalsContact O-N 3.07Å; E48-S50 VanDerWaalsContact C-N 3.27Å; E48-S50 PolarHBondContact O-N 2.95Å; S50-L52 VanDerWaalsContact C-N 3.28Å; S50-L52 PolarHBondContact O-N 2.84Å; S50-R53 PolarHBondContact O-N 3.33Å; S50-R53 VanDerWaalsContact O-N 3.16Å; S50-E54 PolarHBondContact O-N 3.33Å; S50-E54 VanDerWaalsContact O-N 3.09Å
51	M	74.7	Confident	72.6	Confident	113 Å²	113	107 Å²	107	56%	0.557	52%	0.52	S	S	*	.	H	α-helix	trans	-64.1	-31.6	176.2	-66.9	-126.1	-65.9	0	0	112.9	N47 E48 K55	N47-M51 PolarHBondContact O-N 3.34Å; E48-M51 PolarHBondContact O-N 2.97Å; M51-K55 WeakPolarHBondContact O-CB 3.35Å; M51-K55 PolarHBondContact O-N 3.02Å; M51-K55 VanDerWaalsContact O-N 3.12Å
52	L	73	Confident	72.5	Confident	81 Å²	81	106.5 Å²	106.5	42%	0.424	52%	0.515	S	S	.	.	H	α-helix	trans	-70.7	-35.3	173.8	-74.5	171.2	0	0	0	112.7	E48 S50 N56	E48-L52 WeakPolarHBondContact O-CB 3.18Å; E48-L52 VanDerWaalsContact O-CG 3.31Å; E48-L52 WeakPolarHBondContact O-CG 3.4Å; E48-L52 PolarHBondContact O-N 3.41Å; S50-L52 VanDerWaalsContact C-N 3.28Å; S50-L52 PolarHBondContact O-N 2.84Å; L52-N56 WeakPolarHBondContact O-CB 3.34Å; L52-N56 PolarHBondContact O-N 3.44Å
53	R	73.6	Confident	72.3	Confident	135 Å²	135	106.8 Å²	106.8	51%	0.509	52%	0.517	S	S	.	.	H	α-helix	trans	-65.6	-48.8	173.4	-77.8	-176.7	-64.8	-110	-1.8	111.6	N49 S50 K55 N56 E57	N49-R53 WeakPolarHBondContact O-CG 3.27Å; N49-R53 PolarHBondContact O-N 3.47Å; N49-R53 VanDerWaalsContact O-N 3.12Å; S50-R53 PolarHBondContact O-N 3.33Å; S50-R53 VanDerWaalsContact O-N 3.16Å; R53-K55 PolarHBondContact O-N 3.19Å; R53-N56 WeakPolarHBondContact O-CA 3.3Å; R53-N56 WeakPolarHBondContact O-CB 3.36Å; R53-N56 PolarHBondContact O-N 2.78Å; R53-E57 PolarHBondContact O-N 3.46Å
54	E	75.8	Confident	71.9	Confident	124 Å²	124	104 Å²	104	58%	0.579	51%	0.514	S	S	*	.	H	α-helix	trans	-57.4	-46.5	178.4	-170.1	170.9	-158.9	0	0	111.3	S50 N56 E57 E58	S50-E54 PolarHBondContact O-N 3.33Å; S50-E54 VanDerWaalsContact O-N 3.09Å; E54-N56 VanDerWaalsContact C-N 3.31Å; E54-N56 PolarHBondContact O-N 2.93Å; E54-E57 PolarHBondContact O-N 3.45Å; E54-E58 PolarHBondContact O-N 2.84Å
55	K	76.1	Confident	71.9	Confident	122 Å²	122	102.8 Å²	102.8	53%	0.53	51%	0.511	S	S	.	.	H	α-helix	trans	-63.9	-29.8	173.2	-80.1	-174.3	173.9	179.1	0	114.7	M51 R53 L59	M51-K55 WeakPolarHBondContact O-CB 3.35Å; M51-K55 PolarHBondContact O-N 3.02Å; M51-K55 VanDerWaalsContact O-N 3.12Å; R53-K55 PolarHBondContact O-N 3.19Å; K55-L59 WeakPolarHBondContact O-CB 3.46Å; K55-L59 PolarHBondContact O-N 3Å; K55-L59 VanDerWaalsContact O-N 3.09Å
56	N	73.2	Confident	71.9	Confident	82 Å²	82	104 Å²	104	44%	0.439	51%	0.51	S	S	.	.	H	α-helix	trans	-74.1	-37.8	176.9	-166.1	77.4	0	0	0	111.1	L52 R53 E54 L59 E60	L52-N56 WeakPolarHBondContact O-CB 3.34Å; L52-N56 PolarHBondContact O-N 3.44Å; R53-N56 WeakPolarHBondContact O-CA 3.3Å; R53-N56 WeakPolarHBondContact O-CB 3.36Å; R53-N56 PolarHBondContact O-N 2.78Å; E54-N56 VanDerWaalsContact C-N 3.31Å; E54-N56 PolarHBondContact O-N 2.93Å; N56-L59 WeakPolarHBondContact O-CB 3.41Å; N56-L59 PolarHBondContact O-N 3.18Å; N56-E60 PolarHBondContact ND2-OE1 3.23Å; N56-E60 WeakPolarHBondContact O-CG 3.47Å; N56-E60 PolarHBondContact O-N 3.37Å
57	E	75.5	Confident	71.7	Confident	134 Å²	134	104.1 Å²	104.1	63%	0.626	51%	0.508	S	S	*	.	H	α-helix	trans	-63.6	-44.5	172.5	-69.9	174.8	-167.1	0	0	111.4	R53 E54 L59 E60 E61	R53-E57 PolarHBondContact O-N 3.46Å; E54-E57 PolarHBondContact O-N 3.45Å; E57-L59 VanDerWaalsContact C-N 3.29Å; E57-L59 PolarHBondContact O-N 3.44Å; E57-E60 PolarHBondContact O-N 2.88Å; E57-E61 PolarHBondContact O-N 3.29Å
58	E	73	Confident	71.5	Confident	114 Å²	114	102.4 Å²	102.4	53%	0.533	50%	0.499	S	S	.	.	H	α-helix	trans	-57.8	-39.7	171.4	-71.8	-174.1	152.9	0	0	112.6	E54 M62	E54-E58 PolarHBondContact O-N 2.84Å; E58-M62 WeakPolarHBondContact O-CB 3.42Å; E58-M62 WeakPolarHBondContact O-CG 3.39Å; E58-M62 PolarHBondContact O-N 3.39Å
59	L	70.1	Confident	71.5	Confident	91 Å²	91	104.2 Å²	104.2	48%	0.476	51%	0.507	S	S	.	.	H	α-helix	trans	-67.9	-39.6	177.8	-95.9	159.8	0	0	0	112.6	K55 N56 E57 M62 L63	K55-L59 WeakPolarHBondContact O-CB 3.46Å; K55-L59 PolarHBondContact O-N 3Å; K55-L59 VanDerWaalsContact O-N 3.09Å; N56-L59 WeakPolarHBondContact O-CB 3.41Å; N56-L59 PolarHBondContact O-N 3.18Å; E57-L59 VanDerWaalsContact C-N 3.29Å; E57-L59 PolarHBondContact O-N 3.44Å; L59-M62 HydrophobicContact CD2-CE 3.96Å; L59-M62 HydrophobicContact CG-CE 4.09Å; L59-M62 PolarHBondContact O-N 3.29Å; L59-L63 WeakPolarHBondContact O-CB 3.49Å; L59-L63 VanDerWaalsContact O-CG 3.31Å; L59-L63 WeakPolarHBondContact O-CG 3.21Å; L59-L63 PolarHBondContact O-N 2.91Å
60	E	70.5	Confident	71.6	Confident	121 Å²	121	103.6 Å²	103.6	57%	0.565	51%	0.508	S	S	*	.	H	α-helix	trans	-66	-42.9	174.9	-75	-178.4	-164	0	0	111.4	N56 E57 M62 L63 L64	N56-E60 PolarHBondContact ND2-OE1 3.23Å; N56-E60 WeakPolarHBondContact O-CG 3.47Å; N56-E60 PolarHBondContact O-N 3.37Å; E57-E60 PolarHBondContact O-N 2.88Å; E60-M62 PolarHBondContact O-N 3.34Å; E60-L63 PolarHBondContact O-N 3.42Å; E60-L64 PolarHBondContact O-N 2.88Å
61	E	73	Confident	71.7	Confident	131 Å²	131	106 Å²	106	61%	0.612	51%	0.512	S	S	*	.	H	α-helix	trans	-64.4	-40.4	175.1	-170.1	177.5	-173	0	0	112.1	E57 L63 L64 N65	E57-E61 PolarHBondContact O-N 3.29Å; E61-L63 VanDerWaalsContact C-N 3.34Å; E61-L63 PolarHBondContact O-N 2.98Å; E61-L64 PolarHBondContact O-N 3.49Å; E61-N65 WeakPolarHBondContact O-CB 3.32Å; E61-N65 PolarHBondContact O-N 2.88Å; E61-N65 PolarHBondContact O-ND2 2.87Å
62	M	68.4	Low	71.7	Confident	97 Å²	97	105.9 Å²	105.9	48%	0.478	51%	0.508	S	S	.	.	H	α-helix	trans	-63.2	-36.4	172.8	-81.5	-163	-69.8	0	0	113.2	E58 L59 E60 K66	E58-M62 WeakPolarHBondContact O-CB 3.42Å; E58-M62 WeakPolarHBondContact O-CG 3.39Å; E58-M62 PolarHBondContact O-N 3.39Å; L59-M62 HydrophobicContact CD2-CE 3.96Å; L59-M62 HydrophobicContact CG-CE 4.09Å; L59-M62 PolarHBondContact O-N 3.29Å; E60-M62 PolarHBondContact O-N 3.34Å; M62-K66 WeakPolarHBondContact O-CG 3.42Å; M62-K66 PolarHBondContact O-N 2.87Å; M62-K66 VanDerWaalsContact O-N 3.14Å
63	L	65.4	Low	71.8	Confident	105 Å²	105	107.4 Å²	107.4	55%	0.55	52%	0.516	S	S	.	.	H	α-helix	trans	-70	-43.2	177.3	-79.1	166.9	0	0	0	111.4	L59 E60 E61 N65 K66 E67	L59-L63 WeakPolarHBondContact O-CB 3.49Å; L59-L63 VanDerWaalsContact O-CG 3.31Å; L59-L63 WeakPolarHBondContact O-CG 3.21Å; L59-L63 PolarHBondContact O-N 2.91Å; E60-L63 PolarHBondContact O-N 3.42Å; E61-L63 VanDerWaalsContact C-N 3.34Å; E61-L63 PolarHBondContact O-N 2.98Å; L63-N65 PolarHBondContact O-N 2.95Å; L63-K66 WeakPolarHBondContact O-CB 3.44Å; L63-K66 PolarHBondContact O-N 2.91Å; L63-E67 PolarHBondContact O-N 3.34Å
64	L	65.8	Low	71.9	Confident	125 Å²	125	105.5 Å²	105.5	65%	0.654	52%	0.516	S	S	*	.	H	α-helix	trans	-59.5	-46.9	176.7	-162.5	74.9	0	0	0	111.2	E60 E61 K66 E67 D68	E60-L64 PolarHBondContact O-N 2.88Å; E61-L64 PolarHBondContact O-N 3.49Å; L64-K66 VanDerWaalsContact C-N 3.34Å; L64-K66 PolarHBondContact O-N 3.5Å; L64-E67 PolarHBondContact O-N 3.35Å; L64-D68 PolarHBondContact O-N 3.24Å; L64-D68 VanDerWaalsContact O-N 3.11Å
65	N	70	Confident	72	Confident	84 Å²	84	105.8 Å²	105.8	45%	0.449	52%	0.519	S	S	.	.	H	α-helix	trans	-60.8	-38.5	175.6	-80.8	-59	0	0	0	112.7	E61 L63 D68 H69	E61-N65 WeakPolarHBondContact O-CB 3.32Å; E61-N65 PolarHBondContact O-N 2.88Å; E61-N65 PolarHBondContact O-ND2 2.87Å; L63-N65 PolarHBondContact O-N 2.95Å; N65-D68 PolarHBondContact O-N 3.1Å; N65-H69 PolarHBondContact O-CD2 3.46Å; N65-H69 PolarHBondContact O-N 2.96Å
66	K	68.8	Low	72.1	Confident	101 Å²	101	104.8 Å²	104.8	44%	0.439	52%	0.518	S	S	.	.	H	α-helix	trans	-65.5	-39.1	174.7	-79.2	172.4	-175.6	165.3	0	112.9	M62 L63 L64 D68 H69 S70	M62-K66 WeakPolarHBondContact O-CG 3.42Å; M62-K66 PolarHBondContact O-N 2.87Å; M62-K66 VanDerWaalsContact O-N 3.14Å; L63-K66 WeakPolarHBondContact O-CB 3.44Å; L63-K66 PolarHBondContact O-N 2.91Å; L64-K66 VanDerWaalsContact C-N 3.34Å; L64-K66 PolarHBondContact O-N 3.5Å; K66-D68 VanDerWaalsContact C-N 3.3Å; K66-D68 PolarHBondContact O-N 3.37Å; K66-H69 PolarHBondContact O-N 2.88Å; K66-S70 WeakPolarHBondContact O-CB 3.47Å; K66-S70 PolarHBondContact O-N 3.17Å
67	E	67.6	Low	72.3	Confident	102 Å²	102	106 Å²	106	48%	0.477	52%	0.524	S	S	.	.	H	α-helix	trans	-65.8	-38.5	178	-155.4	-167.8	133.6	0	0	111.1	L63 L64 S70 K71	L63-E67 PolarHBondContact O-N 3.34Å; L64-E67 PolarHBondContact O-N 3.35Å; E67-S70 WeakPolarHBondContact O-CB 3.49Å; E67-S70 PolarHBondContact O-N 2.95Å; E67-K71 WeakPolarHBondContact O-CG 3.29Å; E67-K71 PolarHBondContact O-N 3.34Å; E67-K71 WeakPolarHBondContact OE1-CE 3.4Å; E67-K71 IonicContact OE1-NZ 3.6Å; E67-K71 PolarHBondContact OE1-NZ 3Å
68	D	71.9	Confident	72.6	Confident	72 Å²	72	106.6 Å²	106.6	39%	0.385	53%	0.525	S	S	.	.	H	α-helix	trans	-67.7	-39.4	176.6	-135.3	51.8	0	0	0	112.6	L64 N65 K66 K71 K72	L64-D68 PolarHBondContact O-N 3.24Å; L64-D68 VanDerWaalsContact O-N 3.11Å; N65-D68 PolarHBondContact O-N 3.1Å; K66-D68 VanDerWaalsContact C-N 3.3Å; K66-D68 PolarHBondContact O-N 3.37Å; D68-K71 PolarHBondContact O-N 3.48Å; D68-K72 WeakPolarHBondContact O-CG 3.26Å; D68-K72 PolarHBondContact O-N 3.42Å; D68-K72 IonicContact OD2-NZ 2.7Å; D68-K72 PolarHBondContact OD2-NZ 2.88Å
69	H	71.4	Confident	72.9	Confident	125 Å²	125	105.5 Å²	105.5	58%	0.579	52%	0.523	S	S	*	.	H	α-helix	trans	-62.8	-40.1	168.7	-80.1	-61.6	0	0	0	112.4	N65 K66 K72 L73	N65-H69 PolarHBondContact O-CD2 3.46Å; N65-H69 PolarHBondContact O-N 2.96Å; K66-H69 PolarHBondContact O-N 2.88Å; H69-K72 PolarHBondContact O-N 3.34Å; H69-L73 VanDerWaalsContact O-CB 3.3Å; H69-L73 WeakPolarHBondContact O-CB 3.44Å; H69-L73 PolarHBondContact O-N 2.9Å
70	S	71	Confident	73.2	Confident	60 Å²	60	106 Å²	106	42%	0.42	53%	0.525	S	S	.	.	H	α-helix	trans	-62.6	-43.3	175.7	-176.4	0	0	0	0	112.1	K66 E67 L73 N74	K66-S70 WeakPolarHBondContact O-CB 3.47Å; K66-S70 PolarHBondContact O-N 3.17Å; E67-S70 WeakPolarHBondContact O-CB 3.49Å; E67-S70 PolarHBondContact O-N 2.95Å; S70-L73 PolarHBondContact O-N 3.05Å; S70-N74 WeakPolarHBondContact O-CB 3.36Å; S70-N74 PolarHBondContact O-N 2.7Å; S70-N74 PolarHBondContact O-ND2 2.91Å
71	K	76.3	Confident	73.7	Confident	108 Å²	108	107.2 Å²	107.2	47%	0.47	53%	0.528	S	S	.	.	H	α-helix	trans	-61.4	-46.8	174.7	-71.9	165.6	-172.7	159.9	0	111.7	E67 D68 L73 N74 M75	E67-K71 WeakPolarHBondContact O-CG 3.29Å; E67-K71 PolarHBondContact O-N 3.34Å; E67-K71 WeakPolarHBondContact OE1-CE 3.4Å; E67-K71 IonicContact OE1-NZ 3.6Å; E67-K71 PolarHBondContact OE1-NZ 3Å; D68-K71 PolarHBondContact O-N 3.48Å; K71-L73 PolarHBondContact O-N 3.25Å; K71-N74 PolarHBondContact O-N 3.37Å; K71-M75 PolarHBondContact O-N 3.02Å; K71-M75 VanDerWaalsContact O-N 3.07Å
72	K	75.4	Confident	74.1	Confident	110 Å²	110	105.3 Å²	105.3	48%	0.478	52%	0.52	S	S	.	.	H	α-helix	trans	-60.3	-43	175.2	-73.9	163.5	-177.3	144.1	0	112	D68 H69 M75 I76	D68-K72 WeakPolarHBondContact O-CG 3.26Å; D68-K72 PolarHBondContact O-N 3.42Å; D68-K72 IonicContact OD2-NZ 2.7Å; D68-K72 PolarHBondContact OD2-NZ 2.88Å; H69-K72 PolarHBondContact O-N 3.34Å; K72-M75 PolarHBondContact O-N 2.95Å; K72-I76 WeakPolarHBondContact O-CG1 3.43Å; K72-I76 PolarHBondContact O-N 3.34Å
73	L	74.9	Confident	74.5	Confident	113 Å²	113	104.7 Å²	104.7	59%	0.592	52%	0.516	S	S	*	.	H	α-helix	trans	-67.6	-38	-179.6	-159.2	134.9	0	0	0	112	H69 S70 K71 I76 L77	H69-L73 VanDerWaalsContact O-CB 3.3Å; H69-L73 WeakPolarHBondContact O-CB 3.44Å; H69-L73 PolarHBondContact O-N 2.9Å; S70-L73 PolarHBondContact O-N 3.05Å; K71-L73 PolarHBondContact O-N 3.25Å; L73-I76 PolarHBondContact O-N 3.32Å; L73-L77 WeakPolarHBondContact O-CB 3.4Å; L73-L77 PolarHBondContact O-N 2.96Å
74	N	76.7	Confident	75.2	Confident	94 Å²	94	103.9 Å²	103.9	50%	0.503	51%	0.512	S	S	.	.	H	α-helix	trans	-65.8	-37.5	173.3	-79.8	-53.3	0	0	0	113.2	S70 K71 L77 K78	S70-N74 WeakPolarHBondContact O-CB 3.36Å; S70-N74 PolarHBondContact O-N 2.7Å; S70-N74 PolarHBondContact O-ND2 2.91Å; K71-N74 PolarHBondContact O-N 3.37Å; N74-L77 PolarHBondContact O-N 3.27Å; N74-K78 PolarHBondContact O-N 3.01Å
75	M	77.7	Confident	75.7	Confident	131 Å²	131	101.8 Å²	101.8	65%	0.645	50%	0.502	S	S	*	.	H	α-helix	trans	-62.1	-48.5	171.7	-75.9	-179.6	62	0	0	111.4	K71 K72 L77 K78 D79	K71-M75 PolarHBondContact O-N 3.02Å; K71-M75 VanDerWaalsContact O-N 3.07Å; K72-M75 PolarHBondContact O-N 2.95Å; M75-L77 VanDerWaalsContact C-N 3.3Å; M75-L77 PolarHBondContact O-N 2.66Å; M75-K78 WeakPolarHBondContact O-CB 3.37Å; M75-K78 PolarHBondContact O-N 3.22Å; M75-K78 VanDerWaalsContact O-N 3.12Å; M75-D79 PolarHBondContact O-N 3.23Å
76	I	77.9	Confident	76.3	Confident	100 Å²	100	102.7 Å²	102.7	51%	0.513	50%	0.502	S	S	.	.	H	α-helix	trans	-59.4	-41.7	177.5	-67.4	165	0	0	0	111	K72 L73 K78 D79 I80	K72-I76 WeakPolarHBondContact O-CG1 3.43Å; K72-I76 PolarHBondContact O-N 3.34Å; L73-I76 PolarHBondContact O-N 3.32Å; I76-K78 VanDerWaalsContact C-N 3.32Å; I76-K78 PolarHBondContact O-N 3.46Å; I76-D79 PolarHBondContact O-N 2.83Å; I76-I80 HydrophobicContact CG2-CD1 3.73Å; I76-I80 HydrophobicContact CG2-CG1 4.38Å; I76-I80 WeakPolarHBondContact O-CB 3.42Å; I76-I80 VanDerWaalsContact O-CG1 3.27Å; I76-I80 WeakPolarHBondContact O-CG1 3.29Å; I76-I80 PolarHBondContact O-N 2.88Å
77	L	77.7	Confident	76.8	Confident	109 Å²	109	103.7 Å²	103.7	57%	0.571	51%	0.506	S	S	*	.	H	α-helix	trans	-62.4	-38.9	177.2	-153.8	95.7	0	0	0	112.1	L73 N74 M75 K81	L73-L77 WeakPolarHBondContact O-CB 3.4Å; L73-L77 PolarHBondContact O-N 2.96Å; N74-L77 PolarHBondContact O-N 3.27Å; M75-L77 VanDerWaalsContact C-N 3.3Å; M75-L77 PolarHBondContact O-N 2.66Å; L77-K81 WeakPolarHBondContact O-CB 3.49Å; L77-K81 PolarHBondContact O-N 2.73Å
78	K	81.7	Confident	77.3	Confident	146 Å²	146	104.1 Å²	104.1	64%	0.635	51%	0.508	S	S	*	.	H	α-helix	trans	-66.9	-43.1	176.7	-171	179.3	-179.8	-179	0	111.8	N74 M75 I76 K81 M82	N74-K78 PolarHBondContact O-N 3.01Å; M75-K78 WeakPolarHBondContact O-CB 3.37Å; M75-K78 PolarHBondContact O-N 3.22Å; M75-K78 VanDerWaalsContact O-N 3.12Å; I76-K78 VanDerWaalsContact C-N 3.32Å; I76-K78 PolarHBondContact O-N 3.46Å; K78-K81 PolarHBondContact O-N 3.2Å; K78-M82 HydrophobicContact CG-CE 4.48Å; K78-M82 WeakPolarHBondContact O-CG 3.43Å; K78-M82 PolarHBondContact O-N 2.88Å
79	D	78.9	Confident	77.6	Confident	91 Å²	91	107.6 Å²	107.6	49%	0.487	52%	0.522	S	S	.	.	H	α-helix	trans	-66.7	-42.6	177.6	-72.3	-16.6	0	0	0	111.9	M75 I76 K81 M82 E83	M75-D79 PolarHBondContact O-N 3.23Å; I76-D79 PolarHBondContact O-N 2.83Å; D79-K81 VanDerWaalsContact C-N 3.31Å; D79-K81 PolarHBondContact O-N 2.86Å; D79-M82 PolarHBondContact O-N 3.43Å; D79-M82 WeakPolarHBondContact OD1-CE 3.35Å; D79-E83 PolarHBondContact O-N 3.46Å
80	I	77.1	Confident	78.1	Confident	102 Å²	102	106.4 Å²	106.4	52%	0.523	52%	0.518	S	S	.	.	H	α-helix	trans	-58.1	-44.7	172.7	-70.8	168.9	0	0	0	110.4	I76 E83 L84	I76-I80 HydrophobicContact CG2-CD1 3.73Å; I76-I80 HydrophobicContact CG2-CG1 4.38Å; I76-I80 WeakPolarHBondContact O-CB 3.42Å; I76-I80 VanDerWaalsContact O-CG1 3.27Å; I76-I80 WeakPolarHBondContact O-CG1 3.29Å; I76-I80 PolarHBondContact O-N 2.88Å; I80-E83 PolarHBondContact O-N 2.89Å; I80-L84 VanDerWaalsContact O-CB 3.3Å; I80-L84 WeakPolarHBondContact O-CB 3.37Å; I80-L84 PolarHBondContact O-N 3.44Å
81	K	80.5	Confident	78.6	Confident	146 Å²	146	107.4 Å²	107.4	64%	0.635	52%	0.518	S	S	*	.	H	α-helix	trans	-64.1	-42.1	178.4	-169.5	172.6	-176.5	175.7	0	112.4	L77 K78 D79 L84 N85	L77-K81 WeakPolarHBondContact O-CB 3.49Å; L77-K81 PolarHBondContact O-N 2.73Å; K78-K81 PolarHBondContact O-N 3.2Å; D79-K81 VanDerWaalsContact C-N 3.31Å; D79-K81 PolarHBondContact O-N 2.86Å; K81-L84 PolarHBondContact O-N 3.28Å; K81-N85 PolarHBondContact O-N 3.13Å; K81-N85 PolarHBondContact O-OD1 3.13Å
82	M	81.4	Confident	78.7	Confident	91 Å²	91	107.1 Å²	107.1	45%	0.448	52%	0.519	S	S	.	.	H	α-helix	trans	-64	-40.6	175.5	-72.5	-171	-64	0	0	112.5	K78 D79 K86	K78-M82 HydrophobicContact CG-CE 4.48Å; K78-M82 WeakPolarHBondContact O-CG 3.43Å; K78-M82 PolarHBondContact O-N 2.88Å; D79-M82 PolarHBondContact O-N 3.43Å; D79-M82 WeakPolarHBondContact OD1-CE 3.35Å; M82-K86 WeakPolarHBondContact O-CG 3.28Å; M82-K86 PolarHBondContact O-N 2.89Å
83	E	76.9	Confident	78.8	Confident	83 Å²	83	106 Å²	106	39%	0.388	52%	0.515	S	S	.	.	H	α-helix	trans	-72.5	-32.8	178.6	-165.4	60.4	-160.3	0	0	111.9	D79 I80 K86 K87	D79-E83 PolarHBondContact O-N 3.46Å; I80-E83 PolarHBondContact O-N 2.89Å; E83-K86 PolarHBondContact O-N 3.26Å; E83-K86 WeakPolarHBondContact OE2-CD 3.42Å; E83-K86 IonicContact OE2-NZ 2.89Å; E83-K86 PolarHBondContact OE2-NZ 2.85Å; E83-K87 VanDerWaalsContact O-CG 3.28Å; E83-K87 WeakPolarHBondContact O-CG 3.39Å; E83-K87 PolarHBondContact O-N 3.01Å; E83-K87 VanDerWaalsContact O-N 3.08Å
84	L	79.2	Confident	79	Confident	89 Å²	89	105.4 Å²	105.4	47%	0.466	51%	0.512	S	S	.	.	H	α-helix	trans	-65.2	-45.7	174.3	-161.2	150	0	0	0	111.3	I80 K81 K86 K87 E88	I80-L84 VanDerWaalsContact O-CB 3.3Å; I80-L84 WeakPolarHBondContact O-CB 3.37Å; I80-L84 PolarHBondContact O-N 3.44Å; K81-L84 PolarHBondContact O-N 3.28Å; L84-K86 VanDerWaalsContact C-N 3.34Å; L84-K86 PolarHBondContact O-N 3.3Å; L84-K87 WeakPolarHBondContact O-CA 3.34Å; L84-K87 WeakPolarHBondContact O-CB 3.47Å; L84-K87 PolarHBondContact O-N 3.23Å; L84-E88 HydrophobicContact CD2-CG 4.24Å; L84-E88 WeakPolarHBondContact CD2-OE1 3.47Å; L84-E88 PolarHBondContact O-N 3.07Å
85	N	78	Confident	79.2	Confident	81 Å²	81	106.1 Å²	106.1	43%	0.433	51%	0.511	S	S	.	.	H	α-helix	trans	-57	-43.6	173.2	-74.5	25.5	0	0	0	112.2	K81 K87 E88 E89	K81-N85 PolarHBondContact O-N 3.13Å; K81-N85 PolarHBondContact O-OD1 3.13Å; N85-K87 VanDerWaalsContact C-N 3.27Å; N85-K87 PolarHBondContact O-N 3.39Å; N85-E88 PolarHBondContact O-N 3Å; N85-E89 PolarHBondContact O-N 3.07Å
86	K	82.1	Confident	79.2	Confident	103 Å²	103	102.5 Å²	102.5	45%	0.448	50%	0.498	S	S	.	.	H	α-helix	trans	-62.4	-32.9	175	-68.4	179	-147.7	152.8	0	112.8	M82 E83 L84 M90	M82-K86 WeakPolarHBondContact O-CG 3.28Å; M82-K86 PolarHBondContact O-N 2.89Å; E83-K86 PolarHBondContact O-N 3.26Å; E83-K86 WeakPolarHBondContact OE2-CD 3.42Å; E83-K86 IonicContact OE2-NZ 2.89Å; E83-K86 PolarHBondContact OE2-NZ 2.85Å; L84-K86 VanDerWaalsContact C-N 3.34Å; L84-K86 PolarHBondContact O-N 3.3Å; K86-M90 HydrophobicContact CB-CE 4.25Å; K86-M90 WeakPolarHBondContact O-CB 3.48Å; K86-M90 WeakPolarHBondContact O-CE 3.38Å; K86-M90 WeakPolarHBondContact O-CG 3.3Å; K86-M90 PolarHBondContact O-N 2.8Å
87	K	78.6	Confident	79.4	Confident	122 Å²	122	101.5 Å²	101.5	53%	0.53	49%	0.494	S	S	.	.	H	α-helix	trans	-70.9	-36.5	176	-65.9	-71.8	165.8	-166.7	0	111.4	E83 L84 N85 M90 N91	E83-K87 VanDerWaalsContact O-CG 3.28Å; E83-K87 WeakPolarHBondContact O-CG 3.39Å; E83-K87 PolarHBondContact O-N 3.01Å; E83-K87 VanDerWaalsContact O-N 3.08Å; L84-K87 WeakPolarHBondContact O-CA 3.34Å; L84-K87 WeakPolarHBondContact O-CB 3.47Å; L84-K87 PolarHBondContact O-N 3.23Å; N85-K87 VanDerWaalsContact C-N 3.27Å; N85-K87 PolarHBondContact O-N 3.39Å; K87-M90 HydrophobicContact CD-CE 3.92Å; K87-N91 VanDerWaalsContact O-CB 3.31Å; K87-N91 WeakPolarHBondContact O-CB 3.41Å; K87-N91 PolarHBondContact O-N 3.01Å
88	E	77.8	Confident	79.4	Confident	111 Å²	111	100.1 Å²	100.1	52%	0.519	49%	0.487	S	S	.	.	H	α-helix	trans	-65.9	-47.6	172.7	-69.2	178.8	164.6	0	0	111.4	L84 N85 M90 N91 E92	L84-E88 HydrophobicContact CD2-CG 4.24Å; L84-E88 WeakPolarHBondContact CD2-OE1 3.47Å; L84-E88 PolarHBondContact O-N 3.07Å; N85-E88 PolarHBondContact O-N 3Å; E88-M90 VanDerWaalsContact C-N 3.35Å; E88-M90 PolarHBondContact O-N 3.24Å; E88-N91 WeakPolarHBondContact O-CA 3.31Å; E88-N91 WeakPolarHBondContact O-CB 3.46Å; E88-N91 PolarHBondContact O-N 3.42Å; E88-E92 PolarHBondContact O-N 3.35Å
89	E	79	Confident	79.3	Confident	144 Å²	144	99.2 Å²	99.2	67%	0.673	49%	0.487	S	S	*	.	H	α-helix	trans	-56.7	-45.3	174.1	-73.3	-178.6	175.3	0	0	112.5	N85 N91 E92 Q93	N85-E89 PolarHBondContact O-N 3.07Å; E89-N91 VanDerWaalsContact C-N 3.28Å; E89-N91 PolarHBondContact O-N 3.43Å; E89-E92 PolarHBondContact O-N 3.49Å; E89-Q93 WeakPolarHBondContact O-CB 3.34Å; E89-Q93 PolarHBondContact O-N 2.89Å
90	M	81.7	Confident	79.3	Confident	101 Å²	101	99.3 Å²	99.3	50%	0.498	49%	0.486	S	S	.	.	H	α-helix	trans	-63.4	-33.1	174.7	-81	-175.9	-82.3	0	0	112.7	K86 K87 E88 L94	K86-M90 HydrophobicContact CB-CE 4.25Å; K86-M90 WeakPolarHBondContact O-CB 3.48Å; K86-M90 WeakPolarHBondContact O-CE 3.38Å; K86-M90 WeakPolarHBondContact O-CG 3.3Å; K86-M90 PolarHBondContact O-N 2.8Å; K87-M90 HydrophobicContact CD-CE 3.92Å; E88-M90 VanDerWaalsContact C-N 3.35Å; E88-M90 PolarHBondContact O-N 3.24Å; M90-L94 WeakPolarHBondContact O-CB 3.41Å; M90-L94 PolarHBondContact O-N 2.95Å
91	N	80.7	Confident	79.3	Confident	81 Å²	81	98.7 Å²	98.7	43%	0.433	48%	0.483	S	S	.	.	H	α-helix	trans	-73.9	-41	179	-171.9	58.6	0	0	0	111.9	K87 E88 E89 L94 K95	K87-N91 VanDerWaalsContact O-CB 3.31Å; K87-N91 WeakPolarHBondContact O-CB 3.41Å; K87-N91 PolarHBondContact O-N 3.01Å; E88-N91 WeakPolarHBondContact O-CA 3.31Å; E88-N91 WeakPolarHBondContact O-CB 3.46Å; E88-N91 PolarHBondContact O-N 3.42Å; E89-N91 VanDerWaalsContact C-N 3.28Å; E89-N91 PolarHBondContact O-N 3.43Å; N91-L94 PolarHBondContact O-N 2.89Å; N91-K95 WeakPolarHBondContact O-CG 3.48Å; N91-K95 PolarHBondContact O-N 2.56Å
92	E	79.5	Confident	79.3	Confident	102 Å²	102	96.4 Å²	96.4	48%	0.477	48%	0.478	S	S	.	.	H	α-helix	trans	-66.8	-38.5	173.7	-64.9	-47	123.4	0	0	112	E88 E89 L94 K95 S96	E88-E92 PolarHBondContact O-N 3.35Å; E89-E92 PolarHBondContact O-N 3.49Å; E92-L94 VanDerWaalsContact C-N 3.33Å; E92-L94 PolarHBondContact O-N 3.48Å; E92-K95 PolarHBondContact O-N 3.15Å; E92-K95 WeakPolarHBondContact OE1-CE 3.42Å; E92-K95 IonicContact OE1-NZ 2.66Å; E92-K95 PolarHBondContact OE1-NZ 3.48Å; E92-K95 WeakPolarHBondContact OE2-CD 3.42Å; E92-K95 IonicContact OE2-NZ 2.73Å; E92-K95 PolarHBondContact OE2-NZ 3.19Å; E92-S96 PolarHBondContact O-N 3.08Å
93	Q	76.5	Confident	79.2	Confident	87 Å²	87	96.9 Å²	96.9	41%	0.407	48%	0.482	S	S	.	.	H	α-helix	trans	-61.7	-41.8	171	-174.4	59	57.6	0	0	111.4	E89 K95 S96 D97	E89-Q93 WeakPolarHBondContact O-CB 3.34Å; E89-Q93 PolarHBondContact O-N 2.89Å; Q93-K95 PolarHBondContact O-N 3.08Å; Q93-S96 WeakPolarHBondContact O-CB 3.4Å; Q93-S96 PolarHBondContact O-N 3.33Å; Q93-D97 PolarHBondContact NE2-OD1 3.47Å; Q93-D97 VanDerWaalsContact O-CG 3.3Å; Q93-D97 PolarHBondContact O-N 3.48Å
94	L	79.3	Confident	79.2	Confident	99 Å²	99	97.5 Å²	97.5	52%	0.518	49%	0.488	S	S	.	.	H	α-helix	trans	-65.4	-37	177.1	-159.8	100.1	0	0	0	112.5	M90 N91 E92 D97 N98	M90-L94 WeakPolarHBondContact O-CB 3.41Å; M90-L94 PolarHBondContact O-N 2.95Å; N91-L94 PolarHBondContact O-N 2.89Å; E92-L94 VanDerWaalsContact C-N 3.33Å; E92-L94 PolarHBondContact O-N 3.48Å; L94-D97 PolarHBondContact O-N 3Å; L94-N98 WeakPolarHBondContact O-CB 3.39Å; L94-N98 VanDerWaalsContact O-CG 3.23Å; L94-N98 PolarHBondContact O-N 2.82Å; L94-N98 PolarHBondContact O-ND2 3.28Å
95	K	80.4	Confident	79.1	Confident	110 Å²	110	96.7 Å²	96.7	48%	0.478	48%	0.483	S	S	.	.	H	α-helix	trans	-62.6	-43.5	171.7	-73.5	173.3	-177.6	173.2	0	111.5	N91 E92 Q93 N98 M99	N91-K95 WeakPolarHBondContact O-CG 3.48Å; N91-K95 PolarHBondContact O-N 2.56Å; E92-K95 PolarHBondContact O-N 3.15Å; E92-K95 WeakPolarHBondContact OE1-CE 3.42Å; E92-K95 IonicContact OE1-NZ 2.66Å; E92-K95 PolarHBondContact OE1-NZ 3.48Å; E92-K95 WeakPolarHBondContact OE2-CD 3.42Å; E92-K95 IonicContact OE2-NZ 2.73Å; E92-K95 PolarHBondContact OE2-NZ 3.19Å; Q93-K95 PolarHBondContact O-N 3.08Å; K95-N98 PolarHBondContact O-N 3.25Å; K95-M99 PolarHBondContact O-N 3.08Å
96	S	78.8	Confident	79	Confident	54 Å²	54	98.3 Å²	98.3	38%	0.378	49%	0.488	S	S	.	.	H	α-helix	trans	-61.5	-47	176.1	-167.7	0	0	0	0	111.5	E92 Q93 N98 M99 I100	E92-S96 PolarHBondContact O-N 3.08Å; Q93-S96 WeakPolarHBondContact O-CB 3.4Å; Q93-S96 PolarHBondContact O-N 3.33Å; S96-N98 PolarHBondContact O-N 2.96Å; S96-M99 PolarHBondContact O-N 3.4Å; S96-I100 WeakPolarHBondContact O-CG1 3.33Å; S96-I100 PolarHBondContact O-N 3.21Å
97	D	80.5	Confident	78.8	Confident	79 Å²	79	96 Å²	96	42%	0.422	49%	0.485	S	S	.	.	H	α-helix	trans	-63	-40.5	177.8	-68.6	-9.1	0	0	0	111.7	Q93 L94 I100 L101	Q93-D97 PolarHBondContact NE2-OD1 3.47Å; Q93-D97 VanDerWaalsContact O-CG 3.3Å; Q93-D97 PolarHBondContact O-N 3.48Å; L94-D97 PolarHBondContact O-N 3Å; D97-I100 PolarHBondContact O-N 3.39Å; D97-L101 WeakPolarHBondContact O-CB 3.31Å; D97-L101 PolarHBondContact O-N 3.12Å
98	N	79.6	Confident	78.6	Confident	80 Å²	80	95.5 Å²	95.5	43%	0.428	49%	0.486	S	S	.	.	H	α-helix	trans	-64.9	-36.7	174.3	-76.9	-27.7	0	0	0	112.7	L94 K95 S96 L101 N102	L94-N98 WeakPolarHBondContact O-CB 3.39Å; L94-N98 VanDerWaalsContact O-CG 3.23Å; L94-N98 PolarHBondContact O-N 2.82Å; L94-N98 PolarHBondContact O-ND2 3.28Å; K95-N98 PolarHBondContact O-N 3.25Å; S96-N98 PolarHBondContact O-N 2.96Å; N98-L101 PolarHBondContact O-N 3.2Å; N98-N102 WeakPolarHBondContact O-CB 3.45Å; N98-N102 PolarHBondContact O-N 2.79Å; N98-N102 PolarHBondContact O-ND2 3.49Å
99	M	78.7	Confident	78.7	Confident	128 Å²	128	95.2 Å²	95.2	63%	0.631	48%	0.483	S	S	*	.	H	α-helix	trans	-66.8	-40.8	175.2	-169.4	179.3	-175.1	0	0	111.3	K95 S96 N102 N103	K95-M99 PolarHBondContact O-N 3.08Å; S96-M99 PolarHBondContact O-N 3.4Å; M99-N102 PolarHBondContact O-N 2.9Å; M99-N103 VanDerWaalsContact O-CG 3.25Å; M99-N103 PolarHBondContact O-N 2.79Å; M99-N103 PolarHBondContact O-ND2 3.31Å
100	I	78.6	Confident	78.7	Confident	93 Å²	93	91.6 Å²	91.6	48%	0.477	47%	0.471	S	S	.	.	H	α-helix	trans	-64.5	-43.3	174.1	-65.8	165.8	0	0	0	110.7	S96 D97 N103 L104	S96-I100 WeakPolarHBondContact O-CG1 3.33Å; S96-I100 PolarHBondContact O-N 3.21Å; D97-I100 PolarHBondContact O-N 3.39Å; I100-N103 PolarHBondContact O-N 3.34Å; I100-L104 PolarHBondContact O-N 2.95Å
101	L	77.9	Confident	78.4	Confident	88 Å²	88	92.2 Å²	92.2	46%	0.461	47%	0.473	S	S	.	.	H	α-helix	trans	-62.7	-43.3	177.5	-177.9	61.2	0	0	0	111.9	D97 N98 N103 L104 I105	D97-L101 WeakPolarHBondContact O-CB 3.31Å; D97-L101 PolarHBondContact O-N 3.12Å; N98-L101 PolarHBondContact O-N 3.2Å; L101-N103 PolarHBondContact O-N 3.26Å; L101-L104 PolarHBondContact O-N 2.93Å; L101-I105 HydrophobicContact CD1-CD1 4.26Å; L101-I105 HydrophobicContact CD1-CG1 4.46Å; L101-I105 HydrophobicContact CG-CD1 3.96Å; L101-I105 VanDerWaalsContact O-CG1 3.29Å; L101-I105 WeakPolarHBondContact O-CG1 3.31Å; L101-I105 PolarHBondContact O-N 3.41Å
102	N	79.5	Confident	78.1	Confident	98 Å²	98	93.9 Å²	93.9	52%	0.524	48%	0.478	S	S	.	.	H	α-helix	trans	-62.3	-41.7	175.1	-79.2	-22.8	0	0	0	112.1	N98 M99 L104 I105 Q106	N98-N102 WeakPolarHBondContact O-CB 3.45Å; N98-N102 PolarHBondContact O-N 2.79Å; N98-N102 PolarHBondContact O-ND2 3.49Å; M99-N102 PolarHBondContact O-N 2.9Å; N102-L104 VanDerWaalsContact C-N 3.34Å; N102-L104 PolarHBondContact O-N 3.08Å; N102-I105 PolarHBondContact O-N 3.21Å; N102-Q106 WeakPolarHBondContact O-CG 3.44Å; N102-Q106 PolarHBondContact O-N 3.46Å
103	N	79	Confident	78.1	Confident	101 Å²	101	95.1 Å²	95.1	54%	0.54	48%	0.483	S	S	.	.	H	α-helix	trans	-63.6	-39.4	175.3	-70	-15.3	0	0	0	111.8	M99 I100 L101 Q106 S107	M99-N103 VanDerWaalsContact O-CG 3.25Å; M99-N103 PolarHBondContact O-N 2.79Å; M99-N103 PolarHBondContact O-ND2 3.31Å; I100-N103 PolarHBondContact O-N 3.34Å; L101-N103 PolarHBondContact O-N 3.26Å; N103-Q106 PolarHBondContact O-N 2.92Å; N103-S107 PolarHBondContact O-N 3.49Å
104	L	77	Confident	77.9	Confident	96 Å²	96	96.2 Å²	96.2	50%	0.503	49%	0.49	S	S	.	.	H	α-helix	trans	-65.7	-43.9	175.3	-177.3	63.3	0	0	0	111.8	I100 L101 N102 Q106 S107 M108	I100-L104 PolarHBondContact O-N 2.95Å; L101-L104 PolarHBondContact O-N 2.93Å; N102-L104 VanDerWaalsContact C-N 3.34Å; N102-L104 PolarHBondContact O-N 3.08Å; L104-Q106 VanDerWaalsContact C-N 3.32Å; L104-Q106 PolarHBondContact O-N 3.22Å; L104-S107 WeakPolarHBondContact O-CB 3.21Å; L104-S107 PolarHBondContact O-N 3.11Å; L104-M108 HydrophobicContact CD1-CG 4.48Å; L104-M108 HydrophobicContact CG-SD 4.23Å; L104-M108 WeakPolarHBondContact O-CG 3.32Å; L104-M108 PolarHBondContact O-N 2.9Å
105	I	77	Confident	77.7	Confident	72 Å²	72	98 Å²	98	37%	0.369	49%	0.494	S	S	.	.	H	α-helix	trans	-59.8	-42.1	176	-71	165.5	0	0	0	110.9	L101 N102 M108 K109	L101-I105 HydrophobicContact CD1-CD1 4.26Å; L101-I105 HydrophobicContact CD1-CG1 4.46Å; L101-I105 HydrophobicContact CG-CD1 3.96Å; L101-I105 VanDerWaalsContact O-CG1 3.29Å; L101-I105 WeakPolarHBondContact O-CG1 3.31Å; L101-I105 PolarHBondContact O-N 3.41Å; N102-I105 PolarHBondContact O-N 3.21Å; I105-M108 PolarHBondContact O-N 3.37Å; I105-K109 WeakPolarHBondContact O-CG 3.4Å; I105-K109 PolarHBondContact O-N 2.83Å
106	Q	77.4	Confident	77.4	Confident	115 Å²	115	97.3 Å²	97.3	54%	0.537	49%	0.492	S	S	.	.	H	α-helix	trans	-66.2	-42.7	175.8	-67.8	-67.1	3.1	0	0	112	N102 N103 L104 M108 K109 T110	N102-Q106 WeakPolarHBondContact O-CG 3.44Å; N102-Q106 PolarHBondContact O-N 3.46Å; N103-Q106 PolarHBondContact O-N 2.92Å; L104-Q106 VanDerWaalsContact C-N 3.32Å; L104-Q106 PolarHBondContact O-N 3.22Å; Q106-M108 VanDerWaalsContact C-N 3.35Å; Q106-M108 PolarHBondContact O-N 3.49Å; Q106-K109 PolarHBondContact O-N 2.83Å; Q106-T110 PolarHBondContact O-N 3.25Å; Q106-T110 PolarHBondContact O-OG1 3.02Å
107	S	77.2	Confident	77.4	Confident	54 Å²	54	99.2 Å²	99.2	38%	0.378	50%	0.498	S	S	.	.	H	α-helix	trans	-58	-46.5	174.5	-162.9	0	0	0	0	111.6	N103 L104 K109 T110 E111	N103-S107 PolarHBondContact O-N 3.49Å; L104-S107 WeakPolarHBondContact O-CB 3.21Å; L104-S107 PolarHBondContact O-N 3.11Å; S107-K109 VanDerWaalsContact C-N 3.34Å; S107-K109 PolarHBondContact O-N 3.36Å; S107-T110 PolarHBondContact O-N 3.41Å; S107-T110 PolarHBondContact O-OG1 2.9Å; S107-E111 WeakPolarHBondContact O-CG 3.47Å; S107-E111 PolarHBondContact O-N 3.36Å
108	M	74.8	Confident	77.1	Confident	112 Å²	112	100.4 Å²	100.4	55%	0.552	50%	0.504	S	S	*	.	H	α-helix	trans	-63.6	-37.1	177.9	-70.9	178.5	68.1	0	0	112.5	L104 I105 Q106 E111 Q112	L104-M108 HydrophobicContact CD1-CG 4.48Å; L104-M108 HydrophobicContact CG-SD 4.23Å; L104-M108 WeakPolarHBondContact O-CG 3.32Å; L104-M108 PolarHBondContact O-N 2.9Å; I105-M108 PolarHBondContact O-N 3.37Å; Q106-M108 VanDerWaalsContact C-N 3.35Å; Q106-M108 PolarHBondContact O-N 3.49Å; M108-E111 PolarHBondContact O-N 2.9Å; M108-Q112 WeakPolarHBondContact O-CB 3.25Å; M108-Q112 PolarHBondContact O-N 3.46Å
109	K	80.2	Confident	77	Confident	105 Å²	105	101.9 Å²	101.9	46%	0.457	51%	0.506	S	S	.	.	H	α-helix	trans	-62.8	-46.3	172.7	-76.7	-178.6	176.2	-170.8	0	111.9	I105 Q106 S107 E111 Q112 E113	I105-K109 WeakPolarHBondContact O-CG 3.4Å; I105-K109 PolarHBondContact O-N 2.83Å; Q106-K109 PolarHBondContact O-N 2.83Å; S107-K109 VanDerWaalsContact C-N 3.34Å; S107-K109 PolarHBondContact O-N 3.36Å; K109-E111 VanDerWaalsContact C-N 3.32Å; K109-E111 PolarHBondContact O-N 3.28Å; K109-Q112 PolarHBondContact O-N 3.24Å; K109-E113 WeakPolarHBondContact O-CG 3.48Å; K109-E113 PolarHBondContact O-N 3.13Å
110	T	77.4	Confident	76.9	Confident	68 Å²	68	101.3 Å²	101.3	42%	0.417	50%	0.502	S	S	.	.	H	α-helix	trans	-64.5	-35.4	177.6	54.9	0	0	0	0	112.7	Q106 S107 E113 M114	Q106-T110 PolarHBondContact O-N 3.25Å; Q106-T110 PolarHBondContact O-OG1 3.02Å; S107-T110 PolarHBondContact O-N 3.41Å; S107-T110 PolarHBondContact O-OG1 2.9Å; T110-E113 PolarHBondContact O-N 3.06Å; T110-M114 WeakPolarHBondContact O-CG 3.37Å; T110-M114 PolarHBondContact O-N 2.89Å
111	E	75.6	Confident	76.8	Confident	115 Å²	115	99.9 Å²	99.9	54%	0.537	50%	0.495	S	S	.	.	H	α-helix	trans	-67.7	-38.8	173	-73.4	175.9	-178.6	0	0	112	S107 M108 K109 M114 F115	S107-E111 WeakPolarHBondContact O-CG 3.47Å; S107-E111 PolarHBondContact O-N 3.36Å; M108-E111 PolarHBondContact O-N 2.9Å; K109-E111 VanDerWaalsContact C-N 3.32Å; K109-E111 PolarHBondContact O-N 3.28Å; E111-M114 HydrophobicContact CG-CE 4.15Å; E111-M114 PolarHBondContact O-N 2.88Å; E111-F115 WeakPolarHBondContact O-CB 3.47Å; E111-F115 PolarHBondContact O-N 3.36Å
112	Q	76	Confident	76.6	Confident	116 Å²	116	99.6 Å²	99.6	54%	0.542	49%	0.494	S	S	.	.	H	α-helix	trans	-65.6	-41.4	174.7	-174.8	174.2	4	0	0	111.9	M108 K109 F115 H116	M108-Q112 WeakPolarHBondContact O-CB 3.25Å; M108-Q112 PolarHBondContact O-N 3.46Å; K109-Q112 PolarHBondContact O-N 3.24Å; Q112-F115 PolarHBondContact O-N 2.94Å; Q112-H116 PolarHBondContact O-CD2 3.47Å; Q112-H116 PolarHBondContact O-N 2.88Å
113	E	78.2	Confident	76.5	Confident	127 Å²	127	99.8 Å²	99.8	59%	0.593	49%	0.494	S	S	*	.	H	α-helix	trans	-63	-45.1	175.2	-74.1	168.5	-173.9	0	0	112	K109 T110 F115 H116 L117	K109-E113 WeakPolarHBondContact O-CG 3.48Å; K109-E113 PolarHBondContact O-N 3.13Å; T110-E113 PolarHBondContact O-N 3.06Å; E113-F115 PolarHBondContact O-N 3.47Å; E113-H116 PolarHBondContact O-N 3.46Å; E113-L117 PolarHBondContact O-N 3.01Å
114	M	73.3	Confident	76.4	Confident	111 Å²	111	102 Å²	102	55%	0.547	50%	0.495	S	S	.	.	H	α-helix	trans	-60.5	-43.6	173	-71.6	-171.3	-59.1	0	0	111.9	T110 E111 H116 L117 D118	T110-M114 WeakPolarHBondContact O-CG 3.37Å; T110-M114 PolarHBondContact O-N 2.89Å; E111-M114 HydrophobicContact CG-CE 4.15Å; E111-M114 PolarHBondContact O-N 2.88Å; M114-H116 VanDerWaalsContact C-N 3.33Å; M114-H116 PolarHBondContact O-N 2.93Å; M114-L117 PolarHBondContact O-N 3.12Å; M114-D118 PolarHBondContact O-N 3.28Å
115	F	75.2	Confident	76.2	Confident	136 Å²	136	100.9 Å²	100.9	60%	0.596	49%	0.492	S	S	*	.	H	α-helix	trans	-65.1	-35	178.3	-172.9	-100.6	0	0	0	112.9	E111 Q112 E113 K119	E111-F115 WeakPolarHBondContact O-CB 3.47Å; E111-F115 PolarHBondContact O-N 3.36Å; Q112-F115 PolarHBondContact O-N 2.94Å; E113-F115 PolarHBondContact O-N 3.47Å; F115-K119 VanDerWaalsContact O-CB 3.27Å; F115-K119 WeakPolarHBondContact O-CB 3.45Å; F115-K119 PolarHBondContact O-N 3.35Å
116	H	73	Confident	76	Confident	95 Å²	95	100.6 Å²	100.6	44%	0.44	49%	0.491	S	S	.	.	H	α-helix	trans	-64.9	-42.7	171.2	-84.2	-70.9	0	0	0	112	Q112 E113 M114 K119 E120	Q112-H116 PolarHBondContact O-CD2 3.47Å; Q112-H116 PolarHBondContact O-N 2.88Å; E113-H116 PolarHBondContact O-N 3.46Å; M114-H116 VanDerWaalsContact C-N 3.33Å; M114-H116 PolarHBondContact O-N 2.93Å; H116-K119 WeakPolarHBondContact O-CB 3.5Å; H116-K119 PolarHBondContact O-N 3.01Å; H116-E120 PolarHBondContact O-N 3.37Å
117	L	78.4	Confident	76.2	Confident	95 Å²	95	101.4 Å²	101.4	50%	0.497	49%	0.493	S	S	.	.	H	α-helix	trans	-63.8	-44.9	177.3	-175.7	63.8	0	0	0	112.1	E113 M114 K119 E120 N121	E113-L117 PolarHBondContact O-N 3.01Å; M114-L117 PolarHBondContact O-N 3.12Å; L117-K119 VanDerWaalsContact C-N 3.31Å; L117-K119 PolarHBondContact O-N 3.09Å; L117-E120 PolarHBondContact O-N 2.93Å; L117-N121 WeakPolarHBondContact O-CB 3.45Å; L117-N121 VanDerWaalsContact O-CG 3.28Å; L117-N121 PolarHBondContact O-N 3.01Å; L117-N121 PolarHBondContact O-ND2 3.41Å
118	D	75	Confident	76.1	Confident	104 Å²	104	104 Å²	104	56%	0.556	50%	0.499	S	S	*	.	H	α-helix	trans	-62.1	-38.8	175.5	-77	-16.3	0	0	0	111.9	M114 N121 L122	M114-D118 PolarHBondContact O-N 3.28Å; D118-N121 PolarHBondContact O-N 3.05Å; D118-L122 WeakPolarHBondContact O-CB 3.39Å; D118-L122 PolarHBondContact O-N 3.29Å
119	K	76.7	Confident	75.9	Confident	110 Å²	110	102.8 Å²	102.8	48%	0.478	49%	0.494	S	S	.	.	H	α-helix	trans	-63.2	-44.1	174.3	179.8	179	178.8	177.2	0	111.9	F115 H116 L117 L122 I123	F115-K119 VanDerWaalsContact O-CB 3.27Å; F115-K119 WeakPolarHBondContact O-CB 3.45Å; F115-K119 PolarHBondContact O-N 3.35Å; H116-K119 WeakPolarHBondContact O-CB 3.5Å; H116-K119 PolarHBondContact O-N 3.01Å; L117-K119 VanDerWaalsContact C-N 3.31Å; L117-K119 PolarHBondContact O-N 3.09Å; K119-L122 PolarHBondContact O-N 3.16Å; K119-I123 HydrophobicContact CG-CD1 4.09Å; K119-I123 WeakPolarHBondContact O-CD1 3.43Å; K119-I123 VanDerWaalsContact O-CG1 3.25Å; K119-I123 WeakPolarHBondContact O-CG1 3.33Å; K119-I123 PolarHBondContact O-N 3.12Å
120	E	77.8	Confident	75.7	Confident	117 Å²	117	103.9 Å²	103.9	55%	0.547	50%	0.501	S	S	.	.	H	α-helix	trans	-65.7	-42	175.9	-73.9	-166	171	0	0	112.4	H116 L117 I123 R124	H116-E120 PolarHBondContact O-N 3.37Å; L117-E120 PolarHBondContact O-N 2.93Å; E120-I123 PolarHBondContact O-N 3.15Å; E120-R124 PolarHBondContact O-N 3.36Å
121	N	76	Confident	75.8	Confident	62 Å²	62	105.6 Å²	105.6	33%	0.332	50%	0.504	S	S	.	.	H	α-helix	trans	-61	-44.8	175.2	-71.8	-26.2	0	0	0	111.2	L117 D118 I123 R124 T125	L117-N121 WeakPolarHBondContact O-CB 3.45Å; L117-N121 VanDerWaalsContact O-CG 3.28Å; L117-N121 PolarHBondContact O-N 3.01Å; L117-N121 PolarHBondContact O-ND2 3.41Å; D118-N121 PolarHBondContact O-N 3.05Å; N121-I123 PolarHBondContact O-N 3.45Å; N121-R124 PolarHBondContact O-N 2.82Å; N121-R124 PolarHBondContact OD1-NH1 3Å; N121-T125 PolarHBondContact O-N 3.14Å; N121-T125 PolarHBondContact O-OG1 2.94Å; N121-T125 VanDerWaalsContact O-OG1 3.11Å
122	L	74.3	Confident	75.7	Confident	83 Å²	83	103.1 Å²	103.1	44%	0.435	49%	0.494	S	S	.	.	H	α-helix	trans	-63.6	-38.4	176.3	-175.8	63.9	0	0	0	112.6	D118 K119 N126	D118-L122 WeakPolarHBondContact O-CB 3.39Å; D118-L122 PolarHBondContact O-N 3.29Å; K119-L122 PolarHBondContact O-N 3.16Å; L122-N126 WeakPolarHBondContact O-CB 3.44Å; L122-N126 VanDerWaalsContact O-CG 3.3Å; L122-N126 PolarHBondContact O-N 3.31Å
123	I	77	Confident	75.5	Confident	102 Å²	102	102.3 Å²	102.3	52%	0.523	49%	0.492	S	S	.	.	H	α-helix	trans	-63.5	-42.8	173.7	-70.8	164.2	0	0	0	110.6	K119 E120 N121 N126 K127	K119-I123 HydrophobicContact CG-CD1 4.09Å; K119-I123 WeakPolarHBondContact O-CD1 3.43Å; K119-I123 VanDerWaalsContact O-CG1 3.25Å; K119-I123 WeakPolarHBondContact O-CG1 3.33Å; K119-I123 PolarHBondContact O-N 3.12Å; E120-I123 PolarHBondContact O-N 3.15Å; N121-I123 PolarHBondContact O-N 3.45Å; I123-N126 PolarHBondContact O-N 2.99Å; I123-K127 WeakPolarHBondContact O-CB 3.4Å; I123-K127 PolarHBondContact O-N 3.2Å
124	R	76	Confident	75.4	Confident	148 Å²	148	101.8 Å²	101.8	56%	0.558	49%	0.493	S	S	*	.	H	α-helix	trans	-63	-46.7	177.8	-164.2	-177.9	-62	111.7	3.3	111.4	E120 N121 K127 H128	E120-R124 PolarHBondContact O-N 3.36Å; N121-R124 PolarHBondContact O-N 2.82Å; N121-R124 PolarHBondContact OD1-NH1 3Å; R124-K127 PolarHBondContact O-N 3.35Å; R124-H128 PolarHBondContact O-N 3.3Å; R124-H128 VanDerWaalsContact O-N 3.08Å
125	T	73.9	Confident	75.4	Confident	72 Å²	72	100.5 Å²	100.5	44%	0.442	49%	0.492	S	S	.	.	H	α-helix	trans	-64.7	-42.8	177.3	-56.5	0	0	0	0	112.1	N121 K127 H128 L129	N121-T125 PolarHBondContact O-N 3.14Å; N121-T125 PolarHBondContact O-OG1 2.94Å; N121-T125 VanDerWaalsContact O-OG1 3.11Å; T125-K127 PolarHBondContact O-N 3.05Å; T125-H128 PolarHBondContact O-N 3.03Å; T125-L129 HydrophobicContact CG2-CD1 4.24Å; T125-L129 WeakPolarHBondContact O-CG 3.42Å; T125-L129 PolarHBondContact O-N 3.46Å
126	N	73.8	Confident	75.4	Confident	66 Å²	66	100.3 Å²	100.3	35%	0.353	49%	0.491	S	S	.	.	H	α-helix	trans	-61.1	-43.4	175.5	-78.9	-9	0	0	0	111.8	L122 I123 H128 L129 E130	L122-N126 WeakPolarHBondContact O-CB 3.44Å; L122-N126 VanDerWaalsContact O-CG 3.3Å; L122-N126 PolarHBondContact O-N 3.31Å; I123-N126 PolarHBondContact O-N 2.99Å; N126-H128 VanDerWaalsContact C-N 3.29Å; N126-H128 PolarHBondContact O-N 3.28Å; N126-L129 PolarHBondContact O-N 3.39Å; N126-E130 WeakPolarHBondContact O-CG 3.48Å; N126-E130 PolarHBondContact O-N 3.07Å
127	K	79.8	Confident	75.4	Confident	132 Å²	132	99.6 Å²	99.6	57%	0.574	49%	0.489	S	S	*	.	H	α-helix	trans	-62.4	-36.7	176.9	-172.3	179.8	178.7	-174.8	0	112.2	I123 R124 T125 Q131	I123-K127 WeakPolarHBondContact O-CB 3.4Å; I123-K127 PolarHBondContact O-N 3.2Å; R124-K127 PolarHBondContact O-N 3.35Å; T125-K127 PolarHBondContact O-N 3.05Å; K127-Q131 WeakPolarHBondContact O-CG 3.48Å; K127-Q131 PolarHBondContact O-N 3.26Å; K127-Q131 VanDerWaalsContact O-N 3.12Å
128	H	75.5	Confident	75.4	Confident	108 Å²	108	100.1 Å²	100.1	50%	0.5	49%	0.489	S	S	.	.	H	α-helix	trans	-68.9	-41.4	175	-176.2	54.7	0	0	0	112.2	R124 T125 N126 Q131 I132	R124-H128 PolarHBondContact O-N 3.3Å; R124-H128 VanDerWaalsContact O-N 3.08Å; T125-H128 PolarHBondContact O-N 3.03Å; N126-H128 VanDerWaalsContact C-N 3.29Å; N126-H128 PolarHBondContact O-N 3.28Å; H128-Q131 WeakPolarHBondContact O-CB 3.43Å; H128-Q131 PolarHBondContact O-N 3.49Å; H128-I132 WeakPolarHBondContact O-CG1 3.47Å; H128-I132 PolarHBondContact O-N 2.75Å
129	L	71.8	Confident	75.4	Confident	86 Å²	86	99.6 Å²	99.6	45%	0.45	49%	0.486	S	S	.	.	H	α-helix	trans	-63.8	-40.1	173.4	-71.4	170.6	0	0	0	112.3	T125 N126 Q131 I132 I133	T125-L129 HydrophobicContact CG2-CD1 4.24Å; T125-L129 WeakPolarHBondContact O-CG 3.42Å; T125-L129 PolarHBondContact O-N 3.46Å; N126-L129 PolarHBondContact O-N 3.39Å; L129-Q131 VanDerWaalsContact C-N 3.3Å; L129-Q131 PolarHBondContact O-N 3.25Å; L129-I132 PolarHBondContact O-N 2.94Å; L129-I133 WeakPolarHBondContact O-CB 3.42Å; L129-I133 VanDerWaalsContact O-CG1 3.26Å; L129-I133 WeakPolarHBondContact O-CG1 3.4Å; L129-I133 PolarHBondContact O-N 3.47Å
130	E	75.7	Confident	75.2	Confident	128 Å²	128	100.3 Å²	100.3	60%	0.598	49%	0.491	S	S	*	.	H	α-helix	trans	-58.4	-41.9	172.3	-76.3	178.3	172.2	0	0	111.5	N126 I133 L134	N126-E130 WeakPolarHBondContact O-CG 3.48Å; N126-E130 PolarHBondContact O-N 3.07Å; E130-I133 PolarHBondContact O-N 3.46Å; E130-L134 WeakPolarHBondContact O-CB 3.38Å; E130-L134 VanDerWaalsContact O-CG 3.27Å; E130-L134 WeakPolarHBondContact O-CG 3.26Å; E130-L134 PolarHBondContact O-N 2.88Å
131	Q	77.9	Confident	75.2	Confident	104 Å²	104	99.1 Å²	99.1	49%	0.486	48%	0.484	S	S	.	.	H	α-helix	trans	-63.7	-47	174.8	-72.4	173.3	-38.8	0	0	112.1	K127 H128 L129 I133 L134 T135	K127-Q131 WeakPolarHBondContact O-CG 3.48Å; K127-Q131 PolarHBondContact O-N 3.26Å; K127-Q131 VanDerWaalsContact O-N 3.12Å; H128-Q131 WeakPolarHBondContact O-CB 3.43Å; H128-Q131 PolarHBondContact O-N 3.49Å; L129-Q131 VanDerWaalsContact C-N 3.3Å; L129-Q131 PolarHBondContact O-N 3.25Å; Q131-I133 VanDerWaalsContact C-N 3.31Å; Q131-I133 PolarHBondContact O-N 3.41Å; Q131-L134 PolarHBondContact O-N 3.5Å; Q131-T135 PolarHBondContact O-N 3.36Å; Q131-T135 PolarHBondContact O-OG1 2.94Å; Q131-T135 VanDerWaalsContact O-OG1 3.11Å
132	I	73.6	Confident	75.3	Confident	64 Å²	64	102.2 Å²	102.2	33%	0.328	50%	0.495	S	S	.	.	H	α-helix	trans	-59.3	-42.3	177.3	-68.2	164.7	0	0	0	111.2	H128 L129 T135 K136	H128-I132 WeakPolarHBondContact O-CG1 3.47Å; H128-I132 PolarHBondContact O-N 2.75Å; L129-I132 PolarHBondContact O-N 2.94Å; I132-T135 PolarHBondContact O-N 2.94Å; I132-K136 HydrophobicContact CG2-CD 4.47Å; I132-K136 WeakPolarHBondContact O-CG 3.35Å; I132-K136 PolarHBondContact O-N 3.4Å
133	I	71.8	Confident	75.1	Confident	99 Å²	99	102.6 Å²	102.6	51%	0.508	50%	0.496	S	S	.	.	H	α-helix	trans	-65.6	-42.9	178.4	-69.5	165	0	0	0	110.7	L129 E130 Q131 K136 I137	L129-I133 WeakPolarHBondContact O-CB 3.42Å; L129-I133 VanDerWaalsContact O-CG1 3.26Å; L129-I133 WeakPolarHBondContact O-CG1 3.4Å; L129-I133 PolarHBondContact O-N 3.47Å; E130-I133 PolarHBondContact O-N 3.46Å; Q131-I133 VanDerWaalsContact C-N 3.31Å; Q131-I133 PolarHBondContact O-N 3.41Å; I133-K136 PolarHBondContact O-N 3.26Å; I133-I137 HydrophobicContact CG2-CD1 3.79Å; I133-I137 HydrophobicContact CG2-CG1 4.46Å; I133-I137 VanDerWaalsContact O-CG1 3.31Å; I133-I137 WeakPolarHBondContact O-CG1 3.39Å; I133-I137 PolarHBondContact O-N 2.9Å
134	L	76.6	Confident	74.8	Confident	116 Å²	116	102.8 Å²	102.8	61%	0.607	50%	0.498	S	S	*	.	H	α-helix	trans	-61.6	-45	176	-73.3	169.1	0	0	0	112	E130 Q131 K136 I137 E138	E130-L134 WeakPolarHBondContact O-CB 3.38Å; E130-L134 VanDerWaalsContact O-CG 3.27Å; E130-L134 WeakPolarHBondContact O-CG 3.26Å; E130-L134 PolarHBondContact O-N 2.88Å; Q131-L134 PolarHBondContact O-N 3.5Å; L134-K136 VanDerWaalsContact C-N 3.35Å; L134-K136 PolarHBondContact O-N 3.22Å; L134-I137 PolarHBondContact O-N 2.83Å; L134-E138 PolarHBondContact O-N 3.23Å
135	T	74.8	Confident	74.9	Confident	84 Å²	84	101.2 Å²	101.2	52%	0.515	50%	0.497	S	S	.	.	H	α-helix	trans	-62.3	-40.7	176.1	-52.9	0	0	0	0	111.8	Q131 I132 E138 N139	Q131-T135 PolarHBondContact O-N 3.36Å; Q131-T135 PolarHBondContact O-OG1 2.94Å; Q131-T135 VanDerWaalsContact O-OG1 3.11Å; I132-T135 PolarHBondContact O-N 2.94Å; T135-E138 PolarHBondContact O-N 2.96Å; T135-N139 WeakPolarHBondContact O-CB 3.43Å; T135-N139 VanDerWaalsContact O-CG 3.27Å; T135-N139 PolarHBondContact O-N 3.43Å; T135-N139 PolarHBondContact O-OD1 3.31Å
136	K	73.9	Confident	74.9	Confident	132 Å²	132	100.7 Å²	100.7	57%	0.574	49%	0.491	S	S	*	.	H	α-helix	trans	-64.2	-42.5	175.5	-77.2	-173.6	176.5	-171.5	0	112.8	I132 I133 L134 E138 N139 E140	I132-K136 HydrophobicContact CG2-CD 4.47Å; I132-K136 WeakPolarHBondContact O-CG 3.35Å; I132-K136 PolarHBondContact O-N 3.4Å; I133-K136 PolarHBondContact O-N 3.26Å; L134-K136 VanDerWaalsContact C-N 3.35Å; L134-K136 PolarHBondContact O-N 3.22Å; K136-E138 VanDerWaalsContact C-N 3.31Å; K136-E138 PolarHBondContact O-N 3.45Å; K136-N139 PolarHBondContact O-N 3.48Å; K136-E140 WeakPolarHBondContact O-CB 3.31Å; K136-E140 WeakPolarHBondContact O-CG 3.44Å; K136-E140 PolarHBondContact O-N 2.93Å
137	I	73.7	Confident	74.6	Confident	79 Å²	79	100.7 Å²	100.7	41%	0.405	49%	0.492	S	S	.	.	H	α-helix	trans	-62	-40.9	176.1	-70.6	166.5	0	0	0	110.8	I133 L134 E140 K141	I133-I137 HydrophobicContact CG2-CD1 3.79Å; I133-I137 HydrophobicContact CG2-CG1 4.46Å; I133-I137 VanDerWaalsContact O-CG1 3.31Å; I133-I137 WeakPolarHBondContact O-CG1 3.39Å; I133-I137 PolarHBondContact O-N 2.9Å; L134-I137 PolarHBondContact O-N 2.83Å; I137-E140 PolarHBondContact O-N 3.49Å; I137-K141 WeakPolarHBondContact O-CG 3.32Å; I137-K141 PolarHBondContact O-N 2.97Å
138	E	78	Confident	74.4	Confident	107 Å²	107	100.2 Å²	100.2	50%	0.5	49%	0.492	S	S	.	.	H	α-helix	trans	-68.8	-38.8	178.7	-149.8	65.5	-168.1	0	0	112	L134 T135 K136 K141 K142	L134-E138 PolarHBondContact O-N 3.23Å; T135-E138 PolarHBondContact O-N 2.96Å; K136-E138 VanDerWaalsContact C-N 3.31Å; K136-E138 PolarHBondContact O-N 3.45Å; E138-K141 PolarHBondContact O-N 3.45Å; E138-K141 IonicContact OE1-NZ 2.83Å; E138-K141 PolarHBondContact OE1-NZ 3.07Å; E138-K141 WeakPolarHBondContact OE2-CE 3.42Å; E138-K141 IonicContact OE2-NZ 2.85Å; E138-K141 PolarHBondContact OE2-NZ 2.98Å; E138-K142 PolarHBondContact O-N 3.35Å
139	N	74.7	Confident	74.5	Confident	92 Å²	92	100.3 Å²	100.3	49%	0.492	50%	0.495	S	S	.	.	H	α-helix	trans	-65	-39.4	172.9	-69.8	-4.5	0	0	0	112.2	T135 K136 K142 L143	T135-N139 WeakPolarHBondContact O-CB 3.43Å; T135-N139 VanDerWaalsContact O-CG 3.27Å; T135-N139 PolarHBondContact O-N 3.43Å; T135-N139 PolarHBondContact O-OD1 3.31Å; K136-N139 PolarHBondContact O-N 3.48Å; N139-K142 PolarHBondContact O-N 3.25Å; N139-L143 WeakPolarHBondContact O-CB 3.39Å; N139-L143 PolarHBondContact O-N 3.09Å
140	E	71.8	Confident	74.2	Confident	125 Å²	125	97.6 Å²	97.6	58%	0.584	48%	0.48	S	S	*	.	H	α-helix	trans	-66.9	-37.2	175.3	-79	-176.8	177.7	0	0	112.5	K136 I137 L143 L144	K136-E140 WeakPolarHBondContact O-CB 3.31Å; K136-E140 WeakPolarHBondContact O-CG 3.44Å; K136-E140 PolarHBondContact O-N 2.93Å; I137-E140 PolarHBondContact O-N 3.49Å; E140-L143 PolarHBondContact O-N 3.48Å; E140-L144 WeakPolarHBondContact O-CB 3.33Å; E140-L144 WeakPolarHBondContact O-CG 3.39Å; E140-L144 PolarHBondContact O-N 3.25Å
141	K	78.1	Confident	73.9	Confident	93 Å²	93	96.7 Å²	96.7	40%	0.404	48%	0.48	S	S	.	.	H	α-helix	trans	-61.3	-47.8	170.6	-73.4	176.8	-170.8	164.2	0	111.5	I137 E138 L143 L144 E145	I137-K141 WeakPolarHBondContact O-CG 3.32Å; I137-K141 PolarHBondContact O-N 2.97Å; E138-K141 PolarHBondContact O-N 3.45Å; E138-K141 IonicContact OE1-NZ 2.83Å; E138-K141 PolarHBondContact OE1-NZ 3.07Å; E138-K141 WeakPolarHBondContact OE2-CE 3.42Å; E138-K141 IonicContact OE2-NZ 2.85Å; E138-K141 PolarHBondContact OE2-NZ 2.98Å; K141-L143 VanDerWaalsContact C-N 3.31Å; K141-L143 PolarHBondContact O-N 3.47Å; K141-L144 CarbonylContact O-C 3.44Å; K141-L144 WeakPolarHBondContact O-CA 3.45Å; K141-L144 WeakPolarHBondContact O-CB 3.35Å; K141-L144 PolarHBondContact O-N 2.95Å; K141-E145 PolarHBondContact O-N 3.33Å
142	K	78.7	Confident	73.9	Confident	127 Å²	127	98.4 Å²	98.4	55%	0.552	49%	0.488	S	S	*	.	H	α-helix	trans	-59.7	-44.6	179.2	-168	-172.7	173.5	-167.1	0	110.9	E138 N139 L144 E145 D146	E138-K142 PolarHBondContact O-N 3.35Å; N139-K142 PolarHBondContact O-N 3.25Å; K142-L144 VanDerWaalsContact C-N 3.29Å; K142-L144 PolarHBondContact O-N 2.99Å; K142-E145 PolarHBondContact O-N 3.44Å; K142-D146 WeakPolarHBondContact O-CB 3.49Å; K142-D146 PolarHBondContact O-N 3.11Å
143	L	69.6	Low	74	Confident	90 Å²	90	99.6 Å²	99.6	47%	0.471	49%	0.494	S	S	.	.	H	α-helix	trans	-59.3	-35.6	171.8	-86.6	158.8	0	0	0	113.1	N139 E140 K141 N147	N139-L143 WeakPolarHBondContact O-CB 3.39Å; N139-L143 PolarHBondContact O-N 3.09Å; E140-L143 PolarHBondContact O-N 3.48Å; K141-L143 VanDerWaalsContact C-N 3.31Å; K141-L143 PolarHBondContact O-N 3.47Å; L143-N147 VanDerWaalsContact O-CB 3.32Å; L143-N147 WeakPolarHBondContact O-CB 3.42Å; L143-N147 VanDerWaalsContact O-CG 3.23Å; L143-N147 PolarHBondContact O-N 2.97Å; L143-N147 PolarHBondContact O-ND2 2.97Å
144	L	71.8	Confident	73.9	Confident	106 Å²	106	97.3 Å²	97.3	56%	0.555	48%	0.483	S	S	*	.	H	α-helix	trans	-70.6	-38.3	175.1	-80.3	160.9	0	0	0	112.4	E140 K141 K142 Q148	E140-L144 WeakPolarHBondContact O-CB 3.33Å; E140-L144 WeakPolarHBondContact O-CG 3.39Å; E140-L144 PolarHBondContact O-N 3.25Å; K141-L144 CarbonylContact O-C 3.44Å; K141-L144 WeakPolarHBondContact O-CA 3.45Å; K141-L144 WeakPolarHBondContact O-CB 3.35Å; K141-L144 PolarHBondContact O-N 2.95Å; K142-L144 VanDerWaalsContact C-N 3.29Å; K142-L144 PolarHBondContact O-N 2.99Å; L144-Q148 WeakPolarHBondContact O-CG 3.5Å; L144-Q148 PolarHBondContact O-N 2.99Å
145	E	77	Confident	73.9	Confident	115 Å²	115	96.6 Å²	96.6	54%	0.537	48%	0.476	S	S	.	.	H	α-helix	trans	-66.2	-46.9	173.8	-70.2	169.5	-171.3	0	0	110.9	K141 K142 N147 Q148 I149	K141-E145 PolarHBondContact O-N 3.33Å; K142-E145 PolarHBondContact O-N 3.44Å; E145-N147 VanDerWaalsContact C-N 3.32Å; E145-N147 PolarHBondContact O-N 3.5Å; E145-Q148 WeakPolarHBondContact O-CB 3.48Å; E145-Q148 PolarHBondContact O-N 3.38Å; E145-Q148 VanDerWaalsContact O-N 3.13Å; E145-I149 WeakPolarHBondContact O-CG1 3.4Å; E145-I149 PolarHBondContact O-N 3.46Å; E145-I149 VanDerWaalsContact O-N 3.12Å
146	D	73.6	Confident	74.1	Confident	61 Å²	61	97.1 Å²	97.1	33%	0.326	48%	0.476	S	S	.	.	H	α-helix	trans	-60.4	-39.6	175.8	-66.9	-26.7	0	0	0	111.6	K142 I149 L150	K142-D146 WeakPolarHBondContact O-CB 3.49Å; K142-D146 PolarHBondContact O-N 3.11Å; D146-I149 PolarHBondContact O-N 3.01Å; D146-L150 PolarHBondContact O-N 3.37Å; D146-L150 VanDerWaalsContact O-N 3.11Å
147	N	69	Low	74	Confident	67 Å²	67	93 Å²	93	36%	0.358	46%	0.46	S	S	.	.	H	α-helix	trans	-69.9	-32.4	174.9	-77.6	-53.2	0	0	0	113.1	L143 E145 L150 D151	L143-N147 VanDerWaalsContact O-CB 3.32Å; L143-N147 WeakPolarHBondContact O-CB 3.42Å; L143-N147 VanDerWaalsContact O-CG 3.23Å; L143-N147 PolarHBondContact O-N 2.97Å; L143-N147 PolarHBondContact O-ND2 2.97Å; E145-N147 VanDerWaalsContact C-N 3.32Å; E145-N147 PolarHBondContact O-N 3.5Å; N147-L150 WeakPolarHBondContact O-CB 3.5Å; N147-L150 PolarHBondContact O-N 3.49Å; N147-D151 PolarHBondContact O-N 2.92Å
148	Q	75.2	Confident	73.9	Confident	122 Å²	122	96.9 Å²	96.9	57%	0.57	47%	0.469	S	S	*	.	H	α-helix	trans	-65	-42.6	174.1	-78.1	173.7	5.4	0	0	111.3	L144 E145 L150 D151 E152	L144-Q148 WeakPolarHBondContact O-CG 3.5Å; L144-Q148 PolarHBondContact O-N 2.99Å; E145-Q148 WeakPolarHBondContact O-CB 3.48Å; E145-Q148 PolarHBondContact O-N 3.38Å; E145-Q148 VanDerWaalsContact O-N 3.13Å; Q148-L150 PolarHBondContact O-N 3.14Å; Q148-D151 PolarHBondContact O-N 2.94Å; Q148-E152 PolarHBondContact O-N 3.07Å
149	I	76.7	Confident	73.9	Confident	110 Å²	110	96.8 Å²	96.8	56%	0.564	47%	0.469	S	S	*	.	H	α-helix	trans	-61	-37.2	174	-63.6	166	0	0	0	110.7	E145 D146 L153	E145-I149 WeakPolarHBondContact O-CG1 3.4Å; E145-I149 PolarHBondContact O-N 3.46Å; E145-I149 VanDerWaalsContact O-N 3.12Å; D146-I149 PolarHBondContact O-N 3.01Å; I149-L153 WeakPolarHBondContact O-CB 3.49Å; I149-L153 PolarHBondContact O-N 2.68Å
150	L	65.3	Low	74	Confident	29 Å²	29	96.4 Å²	96.4	15%	0.152	46%	0.464	C	S	.	.	H	α-helix	trans	-68.7	-42	176.3	-163.4	82.6	0	0	0	112.9	D146 N147 Q148 E152 L153 I154 Y206 Y210	D146-L150 PolarHBondContact O-N 3.37Å; D146-L150 VanDerWaalsContact O-N 3.11Å; N147-L150 WeakPolarHBondContact O-CB 3.5Å; N147-L150 PolarHBondContact O-N 3.49Å; Q148-L150 PolarHBondContact O-N 3.14Å; L150-E152 VanDerWaalsContact C-N 3.34Å; L150-L153 PolarHBondContact O-N 3.14Å; L150-I154 HydrophobicContact CD2-CD1 4.17Å; L150-I154 HydrophobicContact CG-CD1 4.06Å; L150-I154 WeakPolarHBondContact O-CB 3.36Å; L150-I154 VanDerWaalsContact O-CG1 3.29Å; L150-I154 WeakPolarHBondContact O-CG1 3.31Å; L150-I154 PolarHBondContact O-N 2.64Å; L150-Y206 HydrophobicContact CD1-CD2 4.46Å; L150-Y206 HydrophobicContact CD1-CE2 3.83Å; L150-Y210 HydrophobicContact CD1-CE2 3.97Å; L150-Y210 HydrophobicContact CD2-CE2 3.91Å; L150-Y210 WeakPolarHBondContact CD2-OH 3.45Å
151	D	70.5	Confident	73.9	Confident	109 Å²	109	95.3 Å²	95.3	58%	0.583	46%	0.462	S	S	*	.	H	α-helix	trans	-62.7	-40.9	175.9	-82.7	-23.2	0	0	0	111	N147 Q148 I154 Q155	N147-D151 PolarHBondContact O-N 2.92Å; Q148-D151 PolarHBondContact O-N 2.94Å; D151-I154 PolarHBondContact O-N 3.35Å; D151-Q155 WeakPolarHBondContact O-CB 3.49Å; D151-Q155 PolarHBondContact O-N 2.86Å
152	E	78.7	Confident	73.6	Confident	140 Å²	140	94.8 Å²	94.8	65%	0.654	47%	0.466	S	S	*	.	H	α-helix	trans	-60.3	-46.3	171.6	-73.2	-178.2	175.8	0	0	111.6	Q148 L150 I154 Q155 D156	Q148-E152 PolarHBondContact O-N 3.07Å; L150-E152 VanDerWaalsContact C-N 3.34Å; E152-I154 PolarHBondContact O-N 3.02Å; E152-Q155 WeakPolarHBondContact O-CB 3.5Å; E152-Q155 PolarHBondContact O-N 3.11Å; E152-D156 PolarHBondContact O-N 2.94Å
153	L	74.8	Confident	73.5	Confident	89 Å²	89	93.6 Å²	93.6	47%	0.466	47%	0.469	S	S	.	.	H	α-helix	trans	-61.8	-41.2	176.6	-164.5	96.4	0	0	0	112.1	I149 L150 Q155 D156 L157	I149-L153 WeakPolarHBondContact O-CB 3.49Å; I149-L153 PolarHBondContact O-N 2.68Å; L150-L153 PolarHBondContact O-N 3.14Å; L153-Q155 VanDerWaalsContact C-N 3.33Å; L153-D156 PolarHBondContact O-N 3.45Å; L153-L157 HydrophobicContact CD2-CD1 4.34Å; L153-L157 WeakPolarHBondContact O-CB 3.49Å; L153-L157 WeakPolarHBondContact O-CG 3.49Å; L153-L157 PolarHBondContact O-N 2.84Å
154	I	70.5	Confident	73.5	Confident	51 Å²	51	94.4 Å²	94.4	26%	0.262	47%	0.467	S	S	.	.	H	α-helix	trans	-66.8	-36.3	177.5	-71.4	167.3	0	0	0	111	L150 D151 E152 R158	L150-I154 HydrophobicContact CD2-CD1 4.17Å; L150-I154 HydrophobicContact CG-CD1 4.06Å; L150-I154 WeakPolarHBondContact O-CB 3.36Å; L150-I154 VanDerWaalsContact O-CG1 3.29Å; L150-I154 WeakPolarHBondContact O-CG1 3.31Å; L150-I154 PolarHBondContact O-N 2.64Å; D151-I154 PolarHBondContact O-N 3.35Å; E152-I154 PolarHBondContact O-N 3.02Å; I154-R158 VanDerWaalsContact O-CG 3.26Å; I154-R158 WeakPolarHBondContact O-CG 3.27Å; I154-R158 PolarHBondContact O-N 3.28Å
155	Q	76.4	Confident	73.3	Confident	100 Å²	100	93 Å²	93	47%	0.467	46%	0.463	S	S	.	.	H	α-helix	trans	-63.7	-50.6	174.6	-174.7	69.3	18.6	0	0	110.7	D151 E152 L153 L157 R158 E159	D151-Q155 WeakPolarHBondContact O-CB 3.49Å; D151-Q155 PolarHBondContact O-N 2.86Å; E152-Q155 WeakPolarHBondContact O-CB 3.5Å; E152-Q155 PolarHBondContact O-N 3.11Å; L153-Q155 VanDerWaalsContact C-N 3.33Å; Q155-L157 VanDerWaalsContact C-N 3.31Å; Q155-L157 PolarHBondContact O-N 3.47Å; Q155-R158 WeakPolarHBondContact O-CB 3.33Å; Q155-R158 PolarHBondContact O-N 2.9Å; Q155-R158 VanDerWaalsContact O-N 3.08Å; Q155-E159 PolarHBondContact NE2-OE1 3.42Å; Q155-E159 VanDerWaalsContact NE2-OE1 3.1Å; Q155-E159 PolarHBondContact O-N 3.4Å
156	D	77.5	Confident	72.9	Confident	95 Å²	95	93 Å²	93	51%	0.508	47%	0.465	S	S	.	.	H	α-helix	trans	-54.8	-44.5	175.2	-106.8	29.9	0	0	0	112.2	E152 L153 R158 E159 Q160	E152-D156 PolarHBondContact O-N 2.94Å; L153-D156 PolarHBondContact O-N 3.45Å; D156-R158 PolarHBondContact O-N 3.01Å; D156-E159 PolarHBondContact O-N 2.94Å; D156-Q160 WeakPolarHBondContact O-CG 3.48Å; D156-Q160 PolarHBondContact O-N 2.93Å
157	L	73.6	Confident	72.7	Confident	47 Å²	47	92.9 Å²	92.9	25%	0.246	47%	0.468	C	S	.	.	H	α-helix	trans	-65	-37.3	177.6	-70.8	174.4	0	0	0	112.7	L153 Q155 L161 Q202	L153-L157 HydrophobicContact CD2-CD1 4.34Å; L153-L157 WeakPolarHBondContact O-CB 3.49Å; L153-L157 WeakPolarHBondContact O-CG 3.49Å; L153-L157 PolarHBondContact O-N 2.84Å; Q155-L157 VanDerWaalsContact C-N 3.31Å; Q155-L157 PolarHBondContact O-N 3.47Å; L157-L161 WeakPolarHBondContact O-CB 3.43Å; L157-L161 PolarHBondContact O-N 3.45Å; L157-Q202 VanDerWaalsContact CD2-NE2 3.29Å
158	R	71.3	Confident	72.5	Confident	160 Å²	160	95 Å²	95	60%	0.604	47%	0.474	S	S	*	.	H	α-helix	trans	-68.2	-38.5	175.5	-75.2	170.6	176.8	-154.3	1.1	111.8	I154 Q155 D156 L161 T162	I154-R158 VanDerWaalsContact O-CG 3.26Å; I154-R158 WeakPolarHBondContact O-CG 3.27Å; I154-R158 PolarHBondContact O-N 3.28Å; Q155-R158 WeakPolarHBondContact O-CB 3.33Å; Q155-R158 PolarHBondContact O-N 2.9Å; Q155-R158 VanDerWaalsContact O-N 3.08Å; D156-R158 PolarHBondContact O-N 3.01Å; R158-L161 PolarHBondContact O-N 3.29Å; R158-T162 WeakPolarHBondContact O-CB 3.47Å; R158-T162 PolarHBondContact O-N 2.87Å; R158-T162 PolarHBondContact O-OG1 3.43Å
159	E	76.9	Confident	71.9	Confident	104 Å²	104	92.9 Å²	92.9	49%	0.486	47%	0.47	S	S	.	.	H	α-helix	trans	-65.9	-45.4	175.9	-70.1	-176.6	-162.2	0	0	110.9	Q155 D156 L161 T162 V163	Q155-E159 PolarHBondContact NE2-OE1 3.42Å; Q155-E159 VanDerWaalsContact NE2-OE1 3.1Å; Q155-E159 PolarHBondContact O-N 3.4Å; D156-E159 PolarHBondContact O-N 2.94Å; E159-L161 PolarHBondContact O-N 2.82Å; E159-T162 WeakPolarHBondContact O-CB 3.29Å; E159-T162 PolarHBondContact O-N 3.37Å; E159-T162 VanDerWaalsContact O-N 3.16Å; E159-V163 WeakPolarHBondContact O-CG2 3.42Å; E159-V163 PolarHBondContact O-N 2.99Å
160	Q	76.9	Confident	71.1	Confident	85 Å²	85	96.8 Å²	96.8	40%	0.397	48%	0.477	S	S	.	.	H	α-helix	trans	-59.3	-43.9	173.7	-70	176.4	39.3	0	0	112.8	D156 T162 V163 Y164	D156-Q160 WeakPolarHBondContact O-CG 3.48Å; D156-Q160 PolarHBondContact O-N 2.93Å; Q160-T162 VanDerWaalsContact C-N 3.33Å; Q160-T162 PolarHBondContact O-N 3.31Å; Q160-V163 PolarHBondContact O-N 3.47Å; Q160-Y164 WeakPolarHBondContact O-CB 3.37Å; Q160-Y164 PolarHBondContact O-N 3.21Å
161	L	70.4	Confident	70.7	Confident	101 Å²	101	98.8 Å²	98.8	53%	0.529	49%	0.494	S	S	.	.	H	α-helix	trans	-62.2	-39	174.7	-105.9	155.4	0	0	0	112.4	L157 R158 E159 Y164 T165	L157-L161 WeakPolarHBondContact O-CB 3.43Å; L157-L161 PolarHBondContact O-N 3.45Å; R158-L161 PolarHBondContact O-N 3.29Å; E159-L161 PolarHBondContact O-N 2.82Å; L161-Y164 PolarHBondContact O-N 2.91Å; L161-T165 WeakPolarHBondContact O-CB 3.32Å; L161-T165 PolarHBondContact O-N 3.42Å; L161-T165 PolarHBondContact O-OG1 3.37Å
162	T	71.7	Confident	69.9	Low	82 Å²	82	99.2 Å²	99.2	50%	0.503	50%	0.496	S	S	.	.	H	α-helix	trans	-65.5	-47.7	178.2	-56.8	0	0	0	0	110.5	R158 E159 Q160 Y164 T165 M166	R158-T162 WeakPolarHBondContact O-CB 3.47Å; R158-T162 PolarHBondContact O-N 2.87Å; R158-T162 PolarHBondContact O-OG1 3.43Å; E159-T162 WeakPolarHBondContact O-CB 3.29Å; E159-T162 PolarHBondContact O-N 3.37Å; E159-T162 VanDerWaalsContact O-N 3.16Å; Q160-T162 VanDerWaalsContact C-N 3.33Å; Q160-T162 PolarHBondContact O-N 3.31Å; T162-Y164 PolarHBondContact O-N 3.2Å; T162-T165 PolarHBondContact O-N 3.11Å; T162-M166 WeakPolarHBondContact O-CG 3.33Å; T162-M166 PolarHBondContact O-N 2.95Å
163	V	76.1	Confident	68.5	Low	102 Å²	102	100.7 Å²	100.7	62%	0.618	50%	0.503	S	S	*	.	H	α-helix	trans	-59	-45.3	175.9	172.6	0	0	0	0	111.4	E159 Q160 T165 M166 S167	E159-V163 WeakPolarHBondContact O-CG2 3.42Å; E159-V163 PolarHBondContact O-N 2.99Å; Q160-V163 PolarHBondContact O-N 3.47Å; V163-T165 VanDerWaalsContact C-N 3.33Å; V163-T165 PolarHBondContact O-N 3.11Å; V163-M166 PolarHBondContact O-N 3.21Å; V163-S167 PolarHBondContact O-N 3.4Å; V163-S167 PolarHBondContact O-OG 2.94Å
164	Y	70.3	Confident	67.5	Low	108 Å²	108	100.5 Å²	100.5	42%	0.424	51%	0.509	S	S	.	.	H	α-helix	trans	-63.1	-37.8	176.7	179.9	-106.6	0	0	0	112.8	Q160 L161 T162 S167 K168 N195	Q160-Y164 WeakPolarHBondContact O-CB 3.37Å; Q160-Y164 PolarHBondContact O-N 3.21Å; L161-Y164 PolarHBondContact O-N 2.91Å; T162-Y164 PolarHBondContact O-N 3.2Å; Y164-S167 WeakPolarHBondContact CA-OG 3.43Å; Y164-S167 PolarHBondContact O-N 2.91Å; Y164-S167 PolarHBondContact O-OG 2.85Å; Y164-K168 WeakPolarHBondContact O-CB 3.34Å; Y164-K168 PolarHBondContact O-N 3.21Å; Y164-N195 WeakPolarHBondContact CE2-ND2 3.32Å
165	T	67.2	Low	66.3	Low	77 Å²	77	104.4 Å²	104.4	47%	0.472	53%	0.531	S	S	.	.	H	α-helix	trans	-68.4	-40.5	178.5	-52.5	0	0	0	0	111.1	L161 T162 V163 K168 T169	L161-T165 WeakPolarHBondContact O-CB 3.32Å; L161-T165 PolarHBondContact O-N 3.42Å; L161-T165 PolarHBondContact O-OG1 3.37Å; T162-T165 PolarHBondContact O-N 3.11Å; V163-T165 VanDerWaalsContact C-N 3.33Å; V163-T165 PolarHBondContact O-N 3.11Å; T165-K168 PolarHBondContact O-N 2.95Å; T165-T169 PolarHBondContact O-N 3.43Å; T165-T169 PolarHBondContact O-OG1 2.89Å
166	M	69.3	Low	64.5	Low	115 Å²	115	107.4 Å²	107.4	57%	0.567	55%	0.55	S	S	*	.	H	α-helix	trans	-67.9	-32.7	176.1	-68.6	-170.6	80.5	0	0	113.8	T162 V163 T169	T162-M166 WeakPolarHBondContact O-CG 3.33Å; T162-M166 PolarHBondContact O-N 2.95Å; V163-M166 PolarHBondContact O-N 3.21Å; M166-T169 PolarHBondContact O-OG1 2.87Å
167	S	69	Low	63	Low	58 Å²	58	110 Å²	110	41%	0.406	56%	0.563	S	S	.	*	H	α-helix	trans	-73.1	-34.8	173.1	53.8	0	0	0	0	111.8	V163 Y164 S171	V163-S167 PolarHBondContact O-N 3.4Å; V163-S167 PolarHBondContact O-OG 2.94Å; Y164-S167 WeakPolarHBondContact CA-OG 3.43Å; Y164-S167 PolarHBondContact O-N 2.91Å; Y164-S167 PolarHBondContact O-OG 2.85Å; S167-S171 PolarHBondContact O-N 3.39Å; S167-S171 PolarHBondContact O-OG 3Å
168	K	65	Low	61.5	Low	112 Å²	112	115.9 Å²	115.9	49%	0.487	59%	0.589	S	S	.	*	H	α-helix	trans	-70.5	-37.9	177.4	-168.3	172.2	-179.2	-179.1	0	113.6	Y164 T165 S171 N172	Y164-K168 WeakPolarHBondContact O-CB 3.34Å; Y164-K168 PolarHBondContact O-N 3.21Å; T165-K168 PolarHBondContact O-N 2.95Å; K168-S171 WeakPolarHBondContact O-CB 3.42Å; K168-S171 PolarHBondContact O-N 2.87Å; K168-S171 VanDerWaalsContact O-N 3.12Å; K168-N172 PolarHBondContact O-N 3.5Å
169	T	61.7	Low	60	Low	77 Å²	77	115.1 Å²	115.1	47%	0.472	60%	0.597	S	S	.	*	H	α-helix	trans	-63.2	-44.2	175.2	48.5	0	0	0	0	111.7	T165 M166 S171 N172 E173	T165-T169 PolarHBondContact O-N 3.43Å; T165-T169 PolarHBondContact O-OG1 2.89Å; M166-T169 PolarHBondContact O-OG1 2.87Å; T169-S171 PolarHBondContact O-N 3.4Å; T169-S171 VanDerWaalsContact O-N 3.15Å; T169-N172 PolarHBondContact O-N 3.17Å; T169-N172 VanDerWaalsContact O-N 3.08Å; T169-E173 PolarHBondContact O-N 2.86Å
170	R	61.1	Low	58.2	Low	192 Å²	192	117 Å²	117	73%	0.725	61%	0.61	S	S	*	*	H	α-helix	trans	-59.6	-22.2	172.3	-72.5	-178.3	174.5	-176.6	-0.4	114.6
171	S	56.4	Low	56.5	Low	71 Å²	71	118.6 Å²	118.6	50%	0.497	62%	0.621	S	S	.	*	H	α-helix	trans	-84.4	-20.4	177.8	-52.1	0	0	0	0	113.3	S167 K168 T169 S174	S167-S171 PolarHBondContact O-N 3.39Å; S167-S171 PolarHBondContact O-OG 3Å; K168-S171 WeakPolarHBondContact O-CB 3.42Å; K168-S171 PolarHBondContact O-N 2.87Å; K168-S171 VanDerWaalsContact O-N 3.12Å; T169-S171 PolarHBondContact O-N 3.4Å; T169-S171 VanDerWaalsContact O-N 3.15Å; S171-S174 PolarHBondContact O-OG 3.41Å
172	N	52.4	Low	55.1	Low	118 Å²	118	122.3 Å²	122.3	63%	0.631	64%	0.635	S	S	*	*	H	α-helix	trans	-91.8	-20.5	-176.9	-77.8	9.4	0	0	0	112.7	K168 T169 S174	K168-N172 PolarHBondContact O-N 3.5Å; T169-N172 PolarHBondContact O-N 3.17Å; T169-N172 VanDerWaalsContact O-N 3.08Å; N172-S174 PolarHBondContact O-N 3.21Å
173	E	50.8	Low	53.6	Low	171 Å²	171	127.2 Å²	127.2	80%	0.799	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79	-0.8	179.5	-69	175.4	164.2	0	0	113.7	T169	T169-E173 PolarHBondContact O-N 2.86Å
174	S	52.5	Low	51.8	Low	85 Å²	85	127.7 Å²	127.7	59%	0.594	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.5	-0.7	-174.2	67.8	0	0	0	0	115.9	S171 N172	S171-S174 PolarHBondContact O-OG 3.41Å; N172-S174 PolarHBondContact O-N 3.21Å
175	N	45.4	Very low	50.2	Low	133 Å²	133	127.5 Å²	127.5	71%	0.711	67%	0.669	S	S	*	*			trans	-127.3	63.4	-169.6	-68.2	3.4	0	0	0	113.1
176	D	39.9	Very low	48.7	Very low	163 Å²	163	132.3 Å²	132.3	87%	0.872	69%	0.686	S	S	*	*			trans	-119.5	99.5	160.1	-88.3	-35.1	0	0	0	108.2
177	L	45.6	Very low	47.1	Very low	150 Å²	150	135.9 Å²	135.9	79%	0.785	70%	0.701	S	S	*	*			trans	-173	110.7	161.9	-105.1	162.1	0	0	0	111.5
178	E	41.6	Very low	45.8	Very low	170 Å²	170	137.8 Å²	137.8	79%	0.794	71%	0.712	S	S	*	*			trans	64.7	142.9	145.5	-72.9	170.4	176.5	0	0	124.1
179	D	39.6	Very low	44.3	Very low	144 Å²	144	141 Å²	141	77%	0.77	73%	0.732	S	S	*	*			trans	66.2	95.2	150.8	-70.8	7	0	0	0	124.4
180	D	38.9	Very low	43.1	Very low	142 Å²	142	140.2 Å²	140.2	76%	0.759	74%	0.74	S	S	*	*				65.5	146.2	103	-128.2	2.7	0	0	0	123.2
181	L	41	Very low	42.2	Very low	120 Å²	120	139.5 Å²	139.5	63%	0.628	74%	0.744	S	S	*	*			trans	67.2	121.6	169.6	-86.5	74.3	0	0	0	122
182	H	41.8	Very low	41.4	Very low	179 Å²	179	144.1 Å²	144.1	83%	0.829	76%	0.755	S	S	*	*			trans	98.6	141.1	145	-67.2	-22.3	0	0	0	121
183	H	39.6	Very low	41.1	Very low	185 Å²	185	141.2 Å²	141.2	86%	0.856	74%	0.744	S	S	*	*			trans	-81.7	156.1	-162.5	-83.9	-49.6	0	0	0	114.1
184	P	39	Very low	41.2	Very low	111 Å²	111	137.4 Å²	137.4	72%	0.721	74%	0.736	S	S	*	*			trans	-81.7	168.8	-168	36.4	-39.1	0	0	0	112.8
185	P	37.4	Very low	41.1	Very low	104 Å²	104	136.5 Å²	136.5	68%	0.675	72%	0.724	S	S	*	*				-147.7	164.9	106.2	40.7	-26.6	0	0	0	116.2
186	H	35.2	Very low	41.6	Very low	179 Å²	179	133.8 Å²	133.8	83%	0.829	72%	0.715	S	S	*	*			trans	60.5	97.4	162.3	-55.4	-59	0	0	0	119.4
187	H	35.8	Very low	42.5	Very low	190 Å²	190	129 Å²	129	88%	0.88	69%	0.69	S	S	*	*	P	Polyproline II helix	trans	-93.7	128.6	147.8	-96.8	-64	0	0	0	110.7
188	P	40.5	Very low	43.5	Very low	97 Å²	97	127.5 Å²	127.5	63%	0.63	67%	0.674	S	S	*	*	P	Polyproline II helix	trans	-81.8	153	-176.7	32.2	-35.2	0	0	0	113.3
189	I	34.1	Very low	44.5	Very low	180 Å²	180	124.2 Å²	124.2	92%	0.923	66%	0.662	S	S	*	*	S	Bend	trans	-57.1	131.2	166.7	-62.5	157.6	0	0	0	109.3
190	G	36.8	Very low	45.7	Very low	61 Å²	61	123 Å²	123	63%	0.629	65%	0.651	S	S	*	*			trans	133.5	4.4	160.5	0	0	0	0	0	119.2	K192	G190-K192 PolarHBondContact O-N 3.18Å
191	H	41.5	Very low	47.2	Very low	177 Å²	177	123.5 Å²	123.5	82%	0.819	65%	0.647	S	S	*	*			trans	-69.7	99.4	174	-90	-80.5	0	0	0	111.9	C193	H191-C193 PolarHBondContact O-N 3.07Å
192	K	40.2	Very low	48.6	Very low	167 Å²	167	120.5 Å²	120.5	73%	0.726	63%	0.629	S	S	*	*			trans	-59.8	103.9	165.9	-65	-177.2	177.4	-172.4	0	109.3	G190 S194	G190-K192 PolarHBondContact O-N 3.18Å; K192-S194 PolarHBondContact O-N 3.43Å
193	C	46.4	Very low	49.6	Very low	57 Å²	57	117.1 Å²	117.1	39%	0.385	62%	0.617	S	S	.	*			trans	-67.8	117.2	165.2	175.3	0	0	0	0	107.7	H191 N195 C196 D197	H191-C193 PolarHBondContact O-N 3.07Å; C193-N195 PolarHBondContact O-N 2.97Å; C193-C196 HydrophobicContact CB-CB 3.86Å; C193-C196 WeakPolarHBondContact O-CA 3.46Å; C193-C196 WeakPolarHBondContact O-CB 3.23Å; C193-C196 PolarHBondContact O-N 2.86Å; C193-C196 VanDerWaalsContact SG-SG 3.69Å; C193-D197 PolarHBondContact O-N 3.11Å
194	S	52.1	Low	50.8	Low	91 Å²	91	114.2 Å²	114.2	64%	0.636	60%	0.604	S	S	*	*	H	α-helix	trans	-55.3	-35	179.3	51.5	0	0	0	0	112.3	K192 Y198	K192-S194 PolarHBondContact O-N 3.43Å; S194-Y198 WeakPolarHBondContact O-CB 3.33Å; S194-Y198 PolarHBondContact O-N 2.85Å
195	N	50.2	Low	52	Low	66 Å²	66	111.3 Å²	111.3	35%	0.353	59%	0.589	S	S	.	*	H	α-helix	trans	-71.9	-29.9	175.8	-69.5	11.3	0	0	0	112.3	Y164 C193 L199	Y164-N195 WeakPolarHBondContact CE2-ND2 3.32Å; C193-N195 PolarHBondContact O-N 2.97Å; N195-L199 WeakPolarHBondContact O-CB 3.44Å; N195-L199 PolarHBondContact O-N 3.27Å
196	C	56	Low	52.8	Low	77 Å²	77	110.7 Å²	110.7	52%	0.52	57%	0.574	S	S	.	*	H	α-helix	trans	-74.2	-40.8	173.3	-65	0	0	0	0	111.9	C193 Y198 L199 Q200	C193-C196 HydrophobicContact CB-CB 3.86Å; C193-C196 WeakPolarHBondContact O-CA 3.46Å; C193-C196 WeakPolarHBondContact O-CB 3.23Å; C193-C196 PolarHBondContact O-N 2.86Å; C193-C196 VanDerWaalsContact SG-SG 3.69Å; C196-Y198 VanDerWaalsContact C-N 3.25Å; C196-Y198 PolarHBondContact O-N 3.18Å; C196-L199 PolarHBondContact O-N 2.9Å; C196-Q200 VanDerWaalsContact O-CB 3.23Å; C196-Q200 WeakPolarHBondContact O-CB 3.44Å; C196-Q200 PolarHBondContact O-N 3.01Å
197	D	59.2	Low	53.9	Low	63 Å²	63	107.3 Å²	107.3	34%	0.337	56%	0.561	S	S	.	*	H	α-helix	trans	-61.4	-36.3	172.2	-88.8	4.1	0	0	0	111	C193 K201	C193-D197 PolarHBondContact O-N 3.11Å; D197-K201 WeakPolarHBondContact O-CB 3.3Å; D197-K201 VanDerWaalsContact O-CG 3.31Å; D197-K201 WeakPolarHBondContact O-CG 3.38Å; D197-K201 PolarHBondContact O-N 3.43Å
198	Y	67.6	Low	54.9	Low	117 Å²	117	105 Å²	105	46%	0.459	55%	0.546	S	S	.	.	H	α-helix	trans	-67.8	-49.6	174.3	-173.9	-103.7	0	0	0	112.1	S194 C196 Q200 K201 Q202	S194-Y198 WeakPolarHBondContact O-CB 3.33Å; S194-Y198 PolarHBondContact O-N 2.85Å; C196-Y198 VanDerWaalsContact C-N 3.25Å; C196-Y198 PolarHBondContact O-N 3.18Å; Y198-Q200 VanDerWaalsContact C-N 3.3Å; Y198-Q200 PolarHBondContact O-N 3.45Å; Y198-K201 PolarHBondContact O-N 3.4Å; Y198-Q202 VanDerWaalsContact CE1-CD 3.45Å; Y198-Q202 HydrophobicContact CE1-CG 4.33Å; Y198-Q202 PolarHBondContact O-N 2.95Å; Y198-Q202 PolarHBondContact OH-NE2 2.84Å; Y198-Q202 VanDerWaalsContact OH-NE2 3.07Å
199	L	61	Low	55.3	Low	102 Å²	102	105.6 Å²	105.6	53%	0.534	54%	0.543	S	S	.	.	H	α-helix	trans	-62.4	-37.9	177	-127.6	118.2	0	0	0	111.8	N195 C196 Q202 L203	N195-L199 WeakPolarHBondContact O-CB 3.44Å; N195-L199 PolarHBondContact O-N 3.27Å; C196-L199 PolarHBondContact O-N 2.9Å; L199-Q202 PolarHBondContact O-N 3.4Å; L199-L203 WeakPolarHBondContact O-CB 3.48Å; L199-L203 PolarHBondContact O-N 3.35Å
200	Q	64.4	Low	55.7	Low	117 Å²	117	101.4 Å²	101.4	55%	0.547	52%	0.516	S	S	.	.	H	α-helix	trans	-65.3	-43.4	175.8	-176	173.6	-4.6	0	0	111.1	C196 Y198 Q202 L203 Q204	C196-Q200 VanDerWaalsContact O-CB 3.23Å; C196-Q200 WeakPolarHBondContact O-CB 3.44Å; C196-Q200 PolarHBondContact O-N 3.01Å; Y198-Q200 VanDerWaalsContact C-N 3.3Å; Y198-Q200 PolarHBondContact O-N 3.45Å; Q200-Q202 PolarHBondContact O-N 2.97Å; Q200-L203 PolarHBondContact O-N 3.49Å; Q200-Q204 WeakPolarHBondContact O-CB 3.37Å; Q200-Q204 PolarHBondContact O-N 2.85Å
201	K	72.4	Confident	56	Low	154 Å²	154	100.4 Å²	100.4	67%	0.67	51%	0.506	S	S	*	.	H	α-helix	trans	-61.6	-41	173.7	-78.1	175.1	179.1	-179.7	0	112.4	D197 Y198 Q204 A205	D197-K201 WeakPolarHBondContact O-CB 3.3Å; D197-K201 VanDerWaalsContact O-CG 3.31Å; D197-K201 WeakPolarHBondContact O-CG 3.38Å; D197-K201 PolarHBondContact O-N 3.43Å; Y198-K201 PolarHBondContact O-N 3.4Å; K201-Q204 PolarHBondContact O-N 3.21Å; K201-A205 WeakPolarHBondContact O-CB 3.41Å; K201-A205 PolarHBondContact O-N 2.79Å
202	Q	69.2	Low	56	Low	56 Å²	56	97 Å²	97	26%	0.262	49%	0.491	S	S	.	.	H	α-helix	trans	-67.4	-43.4	175.6	-74.4	-176.2	-26.4	0	0	112.4	L157 Y198 L199 Q200 Q204 A205 Y206	L157-Q202 VanDerWaalsContact CD2-NE2 3.29Å; Y198-Q202 VanDerWaalsContact CE1-CD 3.45Å; Y198-Q202 HydrophobicContact CE1-CG 4.33Å; Y198-Q202 PolarHBondContact O-N 2.95Å; Y198-Q202 PolarHBondContact OH-NE2 2.84Å; Y198-Q202 VanDerWaalsContact OH-NE2 3.07Å; L199-Q202 PolarHBondContact O-N 3.4Å; Q200-Q202 PolarHBondContact O-N 2.97Å; Q202-Q204 VanDerWaalsContact C-N 3.27Å; Q202-Q204 PolarHBondContact O-N 3.22Å; Q202-A205 PolarHBondContact O-N 3.4Å; Q202-Y206 WeakPolarHBondContact O-CB 3.45Å; Q202-Y206 PolarHBondContact O-N 2.92Å
203	L	62.7	Low	55.8	Low	108 Å²	108	94.2 Å²	94.2	57%	0.565	48%	0.483	S	S	*	.	H	α-helix	trans	-63.2	-36.6	175.5	-157.2	83.9	0	0	0	111.3	L199 Q200 Y206 I207	L199-L203 WeakPolarHBondContact O-CB 3.48Å; L199-L203 PolarHBondContact O-N 3.35Å; Q200-L203 PolarHBondContact O-N 3.49Å; L203-Y206 WeakPolarHBondContact O-CB 3.4Å; L203-Y206 PolarHBondContact O-N 2.88Å; L203-I207 HydrophobicContact CD2-CD1 4.48Å; L203-I207 HydrophobicContact CG-CD1 4.4Å; L203-I207 WeakPolarHBondContact O-CB 3.38Å; L203-I207 WeakPolarHBondContact O-CD1 3.33Å; L203-I207 VanDerWaalsContact O-CG1 3.23Å; L203-I207 WeakPolarHBondContact O-CG1 3.14Å; L203-I207 PolarHBondContact O-N 2.9Å
204	Q	65	Low	55.4	Low	124 Å²	124	98 Å²	98	58%	0.579	50%	0.497	S	S	*	.	H	α-helix	trans	-73.3	-34.3	177.5	-162.3	162.4	17.1	0	0	111.9	Q200 K201 Q202 Y208	Q200-Q204 WeakPolarHBondContact O-CB 3.37Å; Q200-Q204 PolarHBondContact O-N 2.85Å; K201-Q204 PolarHBondContact O-N 3.21Å; Q202-Q204 VanDerWaalsContact C-N 3.27Å; Q202-Q204 PolarHBondContact O-N 3.22Å; Q204-Y208 VanDerWaalsContact O-CB 3.28Å; Q204-Y208 WeakPolarHBondContact O-CB 3.21Å; Q204-Y208 PolarHBondContact O-N 3.03Å
205	A	64	Low	54.4	Low	50 Å²	50	97.8 Å²	97.8	41%	0.413	49%	0.489	S	S	.	.	H	α-helix	trans	-67.5	-37.2	168.3	0	0	0	0	0	112.2	K201 Q202 Y208 L209	K201-A205 WeakPolarHBondContact O-CB 3.41Å; K201-A205 PolarHBondContact O-N 2.79Å; Q202-A205 PolarHBondContact O-N 3.4Å; A205-Y208 WeakPolarHBondContact O-CB 3.36Å; A205-Y208 PolarHBondContact O-N 3.04Å; A205-L209 WeakPolarHBondContact O-CB 3.27Å; A205-L209 WeakPolarHBondContact O-CG 3.38Å; A205-L209 PolarHBondContact O-N 3.45Å
206	Y	53.8	Low	53.7	Low	91 Å²	91	100.2 Å²	100.2	36%	0.357	51%	0.509	S	S	.	.	H	α-helix	trans	-64.7	-44.1	174.4	-164.2	-78.2	0	0	0	111.2	L150 Q202 L203 Y208 Y210	L150-Y206 HydrophobicContact CD1-CD2 4.46Å; L150-Y206 HydrophobicContact CD1-CE2 3.83Å; Q202-Y206 WeakPolarHBondContact O-CB 3.45Å; Q202-Y206 PolarHBondContact O-N 2.92Å; L203-Y206 WeakPolarHBondContact O-CB 3.4Å; L203-Y206 PolarHBondContact O-N 2.88Å; Y206-Y208 VanDerWaalsContact C-N 3.32Å; Y206-Y210 AromaticContact CD1-CD2 3.84Å; Y206-Y210 HydrophobicContact CD1-CD2 3.84Å; Y206-Y210 HydrophobicContact CD1-CE2 4.44Å; Y206-Y210 AromaticContact CE1-CD2 3.44Å; Y206-Y210 HydrophobicContact CE1-CD2 3.44Å; Y206-Y210 VanDerWaalsContact CE1-CD2 3.44Å; Y206-Y210 AromaticContact CE1-CE2 3.69Å; Y206-Y210 HydrophobicContact CE1-CE2 3.69Å; Y206-Y210 HydrophobicContact CE1-CG 4.36Å; Y206-Y210 HydrophobicContact CE2-CE2 4.34Å; Y206-Y210 AromaticContact CZ-CD2 3.87Å; Y206-Y210 AromaticContact CZ-CE2 3.63Å; Y206-Y210 WeakPolarHBondContact O-CB 3.34Å; Y206-Y210 PolarHBondContact O-N 2.88Å
207	I	59.4	Low	52.6	Low	109 Å²	109	102.6 Å²	102.6	56%	0.559	52%	0.516	S	S	*	.	H	α-helix	trans	-65.9	-34.2	173.2	-69.4	163.3	0	0	0	111.4	L203 G211	L203-I207 HydrophobicContact CD2-CD1 4.48Å; L203-I207 HydrophobicContact CG-CD1 4.4Å; L203-I207 WeakPolarHBondContact O-CB 3.38Å; L203-I207 WeakPolarHBondContact O-CD1 3.33Å; L203-I207 VanDerWaalsContact O-CG1 3.23Å; L203-I207 WeakPolarHBondContact O-CG1 3.14Å; L203-I207 PolarHBondContact O-N 2.9Å; I207-G211 VanDerWaalsContact O-CA 3.28Å; I207-G211 WeakPolarHBondContact O-CA 3.27Å; I207-G211 PolarHBondContact O-N 2.87Å
208	Y	57.2	Low	51.4	Low	141 Å²	141	105.2 Å²	105.2	55%	0.553	54%	0.535	S	S	*	.	H	α-helix	trans	-66.2	-52.6	175.3	-170.8	-91.9	0	0	0	110.9	Q204 A205 Y206 Y210 G211 E212	Q204-Y208 VanDerWaalsContact O-CB 3.28Å; Q204-Y208 WeakPolarHBondContact O-CB 3.21Å; Q204-Y208 PolarHBondContact O-N 3.03Å; A205-Y208 WeakPolarHBondContact O-CB 3.36Å; A205-Y208 PolarHBondContact O-N 3.04Å; Y206-Y208 VanDerWaalsContact C-N 3.32Å; Y208-Y210 PolarHBondContact O-N 2.91Å; Y208-G211 PolarHBondContact O-N 2.93Å; Y208-E212 HydrophobicContact CE1-CG 4.25Å; Y208-E212 WeakPolarHBondContact CE1-OE1 3.49Å; Y208-E212 WeakPolarHBondContact CE1-OE2 3.49Å; Y208-E212 WeakPolarHBondContact O-CB 3.4Å; Y208-E212 PolarHBondContact O-N 3.36Å; Y208-E212 PolarHBondContact OH-OE1 3.34Å
209	L	47.5	Very low	49.6	Very low	110 Å²	110	107.4 Å²	107.4	58%	0.576	55%	0.549	S	S	*	.	H	α-helix	trans	-60.4	-44.3	177.7	-75.1	162.5	0	0	0	112.9	A205 L213	A205-L209 WeakPolarHBondContact O-CB 3.27Å; A205-L209 WeakPolarHBondContact O-CG 3.38Å; A205-L209 PolarHBondContact O-N 3.45Å; L209-L213 WeakPolarHBondContact O-CG 3.43Å; L209-L213 PolarHBondContact O-N 3.41Å
210	Y	43	Very low	48.2	Very low	91 Å²	91	108.6 Å²	108.6	36%	0.357	56%	0.556	S	S	.	*	H	α-helix	trans	-78.8	-21.4	176.8	-92.7	-79.4	0	0	0	114.3	L150 Y206 Y208 L213	L150-Y210 HydrophobicContact CD1-CE2 3.97Å; L150-Y210 HydrophobicContact CD2-CE2 3.91Å; L150-Y210 WeakPolarHBondContact CD2-OH 3.45Å; Y206-Y210 AromaticContact CD1-CD2 3.84Å; Y206-Y210 HydrophobicContact CD1-CD2 3.84Å; Y206-Y210 HydrophobicContact CD1-CE2 4.44Å; Y206-Y210 AromaticContact CE1-CD2 3.44Å; Y206-Y210 HydrophobicContact CE1-CD2 3.44Å; Y206-Y210 VanDerWaalsContact CE1-CD2 3.44Å; Y206-Y210 AromaticContact CE1-CE2 3.69Å; Y206-Y210 HydrophobicContact CE1-CE2 3.69Å; Y206-Y210 HydrophobicContact CE1-CG 4.36Å; Y206-Y210 HydrophobicContact CE2-CE2 4.34Å; Y206-Y210 AromaticContact CZ-CD2 3.87Å; Y206-Y210 AromaticContact CZ-CE2 3.63Å; Y206-Y210 WeakPolarHBondContact O-CB 3.34Å; Y206-Y210 PolarHBondContact O-N 2.88Å; Y208-Y210 PolarHBondContact O-N 2.91Å; Y210-L213 HydrophobicContact CD1-CD1 4.49Å
211	G	42.8	Very low	46.6	Very low	40 Å²	40	109.5 Å²	109.5	41%	0.412	56%	0.564	S	S	.	*	H	α-helix	trans	-78.9	-38.9	175.6	0	0	0	0	0	112.6	I207 Y208 L213 I214	I207-G211 VanDerWaalsContact O-CA 3.28Å; I207-G211 WeakPolarHBondContact O-CA 3.27Å; I207-G211 PolarHBondContact O-N 2.87Å; Y208-G211 PolarHBondContact O-N 2.93Å; G211-L213 VanDerWaalsContact C-N 3.32Å; G211-I214 CarbonylContact O-C 3.59Å; G211-I214 WeakPolarHBondContact O-CA 3.44Å; G211-I214 PolarHBondContact O-N 3.43Å
212	E	42.3	Very low	44.7	Very low	107 Å²	107	107.6 Å²	107.6	50%	0.5	57%	0.566	S	S	.	*	H	α-helix	trans	-73.2	-21.5	174.9	-72.1	-167.6	148.6	0	0	113.2	Y208 I214 D215	Y208-E212 HydrophobicContact CE1-CG 4.25Å; Y208-E212 WeakPolarHBondContact CE1-OE1 3.49Å; Y208-E212 WeakPolarHBondContact CE1-OE2 3.49Å; Y208-E212 WeakPolarHBondContact O-CB 3.4Å; Y208-E212 PolarHBondContact O-N 3.36Å; Y208-E212 PolarHBondContact OH-OE1 3.34Å; E212-I214 PolarHBondContact O-N 3.45Å; E212-D215 WeakPolarHBondContact O-CB 3.27Å; E212-D215 PolarHBondContact O-N 2.91Å; E212-D215 VanDerWaalsContact O-N 3.08Å
213	L	35.8	Very low	42.8	Very low	108 Å²	108	110.9 Å²	110.9	57%	0.565	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.9	-5.1	165.3	-74.4	171.1	0	0	0	113.3	L209 Y210 G211	L209-L213 WeakPolarHBondContact O-CG 3.43Å; L209-L213 PolarHBondContact O-N 3.41Å; Y210-L213 HydrophobicContact CD1-CD1 4.49Å; G211-L213 VanDerWaalsContact C-N 3.32Å
214	I	36.9	Very low	41.2	Very low	135 Å²	135	113 Å²	113	69%	0.692	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.2	42.9	167.5	-39.5	178.5	0	0	0	109.7	G211 E212 P216	G211-I214 CarbonylContact O-C 3.59Å; G211-I214 WeakPolarHBondContact O-CA 3.44Å; G211-I214 PolarHBondContact O-N 3.43Å; E212-I214 PolarHBondContact O-N 3.45Å; I214-P216 WeakPolarHBondContact O-CD 3.38Å
215	D	32.3	Very low	39.4	Very low	87 Å²	87	111 Å²	111	47%	0.465	60%	0.596	S	S	.	*			trans	-74.6	114.4	165.2	-169	-3.2	0	0	0	109.9	E212 N217	E212-D215 WeakPolarHBondContact O-CB 3.27Å; E212-D215 PolarHBondContact O-N 2.91Å; E212-D215 VanDerWaalsContact O-N 3.08Å; D215-N217 PolarHBondContact O-N 3.38Å; D215-N217 VanDerWaalsContact O-N 3.13Å; D215-N217 WeakPolarHBondContact OD1-CB 3.36Å; D215-N217 PolarHBondContact OD1-N 3.06Å; D215-N217 PolarHBondContact OD1-ND2 3.33Å
216	P	34.6	Very low	37.9	Very low	117 Å²	117	111.6 Å²	111.6	76%	0.76	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.1	-1.7	177.4	-13.6	31.5	0	0	0	113.2	I214	I214-P216 WeakPolarHBondContact O-CD 3.38Å
217	N	33.5	Very low	36.9	Very low	127 Å²	127	115.4 Å²	115.4	68%	0.679	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.1	18.2	-176.4	-61.7	-60	0	0	0	115	D215 Q219	D215-N217 PolarHBondContact O-N 3.38Å; D215-N217 VanDerWaalsContact O-N 3.13Å; D215-N217 WeakPolarHBondContact OD1-CB 3.36Å; D215-N217 PolarHBondContact OD1-N 3.06Å; D215-N217 PolarHBondContact OD1-ND2 3.33Å; N217-Q219 PolarHBondContact O-N 3.07Å
218	V	34	Very low	35.8	Very low	119 Å²	119	116.6 Å²	116.6	72%	0.721	62%	0.619	S	S	*	*			trans	-67.1	91.6	152.5	-178.4	0	0	0	0	106.6	D220	V218-D220 PolarHBondContact O-N 3.38Å
219	Q	30.7	Very low	34.8	Very low	163 Å²	163	113.5 Å²	113.5	76%	0.762	61%	0.609	S	S	*	*			trans	-64.2	84.9	179.9	-167.1	165.7	-5.4	0	0	108.1	N217 N221	N217-Q219 PolarHBondContact O-N 3.07Å; Q219-N221 PolarHBondContact O-N 2.95Å
220	D	31.9	Very low	34.2	Very low	126 Å²	126	113.4 Å²	113.4	67%	0.674	61%	0.609	S	S	*	*			trans	-50.4	116.4	164.7	-109.6	-23.3	0	0	0	105.9	V218 T222	V218-D220 PolarHBondContact O-N 3.38Å; D220-T222 HydrophobicContact CB-CG2 4.39Å; D220-T222 PolarHBondContact O-N 3.34Å; D220-T222 PolarHBondContact O-OG1 2.92Å
221	N	29.3	Very low	34	Very low	137 Å²	137	112.4 Å²	112.4	73%	0.733	61%	0.612	S	S	*	*			trans	-72.6	41.8	172.9	-75.3	-29.9	0	0	0	110.6	Q219 D223	Q219-N221 PolarHBondContact O-N 2.95Å; N221-D223 PolarHBondContact O-N 3.47Å
222	T	32	Very low	33.8	Very low	113 Å²	113	114.9 Å²	114.9	69%	0.693	61%	0.613	S	S	*	*			trans	-68.7	54.5	149.2	52.6	0	0	0	0	109.6	D220 N224	D220-T222 HydrophobicContact CB-CG2 4.39Å; D220-T222 PolarHBondContact O-N 3.34Å; D220-T222 PolarHBondContact O-OG1 2.92Å; T222-N224 VanDerWaalsContact C-N 3.29Å; T222-N224 PolarHBondContact O-N 2.64Å
223	D	29.3	Very low	33.6	Very low	126 Å²	126	114.8 Å²	114.8	67%	0.674	61%	0.611	S	S	*	*			trans	-65.8	96.6	161.9	-109.2	-25.6	0	0	0	107.2	N221 C225	N221-D223 PolarHBondContact O-N 3.47Å; D223-C225 PolarHBondContact O-N 2.96Å
224	N	29.7	Very low	33.7	Very low	153 Å²	153	113.4 Å²	113.4	82%	0.818	61%	0.61	S	S	*	*	S	Bend	trans	29.9	69.6	145.8	-64	-51.5	0	0	0	116.3	T222	T222-N224 VanDerWaalsContact C-N 3.29Å; T222-N224 PolarHBondContact O-N 2.64Å
225	C	28.5	Very low	33.7	Very low	82 Å²	82	114.8 Å²	114.8	55%	0.554	61%	0.611	S	S	*	*			trans	-129.4	87.5	154	-156.7	0	0	0	0	108.1	D223	D223-C225 PolarHBondContact O-N 2.96Å
226	S	31.1	Very low	34	Very low	61 Å²	61	119 Å²	119	43%	0.427	62%	0.621	S	S	.	*			trans	-58.1	141.4	177.7	58.6	0	0	0	0	109.8	E228 E229	S226-E228 PolarHBondContact O-N 2.89Å; S226-E229 PolarHBondContact O-N 3.02Å; S226-E229 PolarHBondContact OG-N 2.86Å
227	F	32.8	Very low	33.9	Very low	172 Å²	172	120.1 Å²	120.1	75%	0.754	62%	0.62	S	S	*	*	H	α-helix	trans	-60.4	-20	176.4	-147	-101.9	0	0	0	111.8	T231	F227-T231 PolarHBondContact O-N 3.08Å; F227-T231 PolarHBondContact O-OG1 2.66Å
228	E	37.2	Very low	34	Very low	133 Å²	133	120 Å²	120	62%	0.621	62%	0.618	S	S	*	*	H	α-helix	trans	-68.2	-37.7	171	-69	164.7	129	0	0	113	S226 L230 T231 E232	S226-E228 PolarHBondContact O-N 2.89Å; E228-L230 VanDerWaalsContact C-N 3.32Å; E228-L230 PolarHBondContact O-N 3.11Å; E228-T231 WeakPolarHBondContact CA-OG1 3.46Å; E228-T231 PolarHBondContact O-N 3.13Å; E228-T231 PolarHBondContact O-OG1 3.29Å; E228-E232 WeakPolarHBondContact O-CB 3.42Å; E228-E232 PolarHBondContact O-N 2.99Å
229	E	35.1	Very low	33.8	Very low	76 Å²	76	120 Å²	120	36%	0.355	62%	0.62	S	S	.	*	H	α-helix	trans	-69.9	-31.2	-179.2	-138.2	-155.5	170.5	0	0	112.2	S226 K233	S226-E229 PolarHBondContact O-N 3.02Å; S226-E229 PolarHBondContact OG-N 2.86Å; E229-K233 VanDerWaalsContact CD-CE 3.47Å; E229-K233 VanDerWaalsContact O-CB 3.28Å; E229-K233 WeakPolarHBondContact O-CB 3.04Å; E229-K233 WeakPolarHBondContact O-CD 3.41Å; E229-K233 VanDerWaalsContact O-CG 3.23Å; E229-K233 WeakPolarHBondContact O-CG 3.3Å; E229-K233 PolarHBondContact O-N 3.03Å; E229-K233 WeakPolarHBondContact OE1-CE 3.42Å; E229-K233 IonicContact OE1-NZ 2.75Å; E229-K233 PolarHBondContact OE1-NZ 2.99Å; E229-K233 IonicContact OE2-NZ 3.85Å; E229-K233 PolarHBondContact OE2-NZ 3.01Å
230	L	35.2	Very low	33.6	Very low	109 Å²	109	117.6 Å²	117.6	57%	0.571	62%	0.622	S	S	*	*	H	α-helix	trans	-73.7	-34.2	173.2	-80	164.2	0	0	0	112.5	E228 S234	E228-L230 VanDerWaalsContact C-N 3.32Å; E228-L230 PolarHBondContact O-N 3.11Å; L230-S234 WeakPolarHBondContact O-CB 3.44Å; L230-S234 PolarHBondContact O-N 3.43Å; L230-S234 VanDerWaalsContact O-N 3.16Å
231	T	39.4	Very low	33.4	Very low	69 Å²	69	118.1 Å²	118.1	42%	0.423	63%	0.625	S	S	.	*	H	α-helix	trans	-79.2	-26.1	174.7	43.5	0	0	0	0	112.9	F227 E228 K235	F227-T231 PolarHBondContact O-N 3.08Å; F227-T231 PolarHBondContact O-OG1 2.66Å; E228-T231 WeakPolarHBondContact CA-OG1 3.46Å; E228-T231 PolarHBondContact O-N 3.13Å; E228-T231 PolarHBondContact O-OG1 3.29Å; T231-K235 VanDerWaalsContact O-CG 3.32Å; T231-K235 WeakPolarHBondContact O-CG 3.45Å; T231-K235 PolarHBondContact O-N 3.44Å
232	E	39.3	Very low	33.6	Very low	93 Å²	93	120.9 Å²	120.9	44%	0.435	63%	0.63	S	S	.	*	H	α-helix	trans	-75.5	-42.9	168.3	-79.5	-148.4	100.5	0	0	113.1	E228 S234 K235 R236	E228-E232 WeakPolarHBondContact O-CB 3.42Å; E228-E232 PolarHBondContact O-N 2.99Å; E232-S234 VanDerWaalsContact C-N 3.25Å; E232-S234 PolarHBondContact O-N 3.48Å; E232-K235 WeakPolarHBondContact O-CB 3.4Å; E232-K235 PolarHBondContact O-N 2.87Å; E232-R236 VanDerWaalsContact CD-NH2 3.29Å; E232-R236 WeakPolarHBondContact O-CG 3.46Å; E232-R236 PolarHBondContact O-N 3.49Å; E232-R236 VanDerWaalsContact O-N 3.13Å; E232-R236 IonicContact OE1-CZ 3.95Å; E232-R236 IonicContact OE1-NH2 3.22Å; E232-R236 PolarHBondContact OE1-NH2 2.99Å; E232-R236 IonicContact OE2-NH2 2.64Å; E232-R236 PolarHBondContact OE2-NH2 2.88Å
233	K	37.5	Very low	33.5	Very low	105 Å²	105	122.8 Å²	122.8	46%	0.457	64%	0.635	S	S	.	*	H	α-helix	trans	-64.6	-30.7	175.9	-74.7	167.8	-176.4	166.1	0	112	E229 R236	E229-K233 VanDerWaalsContact CD-CE 3.47Å; E229-K233 VanDerWaalsContact O-CB 3.28Å; E229-K233 WeakPolarHBondContact O-CB 3.04Å; E229-K233 WeakPolarHBondContact O-CD 3.41Å; E229-K233 VanDerWaalsContact O-CG 3.23Å; E229-K233 WeakPolarHBondContact O-CG 3.3Å; E229-K233 PolarHBondContact O-N 3.03Å; E229-K233 WeakPolarHBondContact OE1-CE 3.42Å; E229-K233 IonicContact OE1-NZ 2.75Å; E229-K233 PolarHBondContact OE1-NZ 2.99Å; E229-K233 IonicContact OE2-NZ 3.85Å; E229-K233 PolarHBondContact OE2-NZ 3.01Å; K233-R236 PolarHBondContact O-N 3.26Å
234	S	37.9	Very low	33.4	Very low	78 Å²	78	122.7 Å²	122.7	55%	0.545	64%	0.642	S	S	.	*	H	α-helix	trans	-66.9	-34.7	169.5	-172	0	0	0	0	113.1	L230 E232	L230-S234 WeakPolarHBondContact O-CB 3.44Å; L230-S234 PolarHBondContact O-N 3.43Å; L230-S234 VanDerWaalsContact O-N 3.16Å; E232-S234 VanDerWaalsContact C-N 3.25Å; E232-S234 PolarHBondContact O-N 3.48Å
235	K	36.4	Very low	33.5	Very low	165 Å²	165	121.4 Å²	121.4	72%	0.717	64%	0.64	S	S	*	*	H	α-helix	trans	-74.3	-19.5	176	-73.8	169.4	-178.1	174.2	0	114.1	T231 E232	T231-K235 VanDerWaalsContact O-CG 3.32Å; T231-K235 WeakPolarHBondContact O-CG 3.45Å; T231-K235 PolarHBondContact O-N 3.44Å; E232-K235 WeakPolarHBondContact O-CB 3.4Å; E232-K235 PolarHBondContact O-N 2.87Å
236	R	38.6	Very low	33.6	Very low	175 Å²	175	126.9 Å²	126.9	66%	0.66	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.7	-5.2	-178.7	-65.8	179.7	-164.2	169.7	11.7	114.8	E232 K233	E232-R236 VanDerWaalsContact CD-NH2 3.29Å; E232-R236 WeakPolarHBondContact O-CG 3.46Å; E232-R236 PolarHBondContact O-N 3.49Å; E232-R236 VanDerWaalsContact O-N 3.13Å; E232-R236 IonicContact OE1-CZ 3.95Å; E232-R236 IonicContact OE1-NH2 3.22Å; E232-R236 PolarHBondContact OE1-NH2 2.99Å; E232-R236 IonicContact OE2-NH2 2.64Å; E232-R236 PolarHBondContact OE2-NH2 2.88Å; K233-R236 PolarHBondContact O-N 3.26Å
237	N	33.6	Very low	33.6	Very low	140 Å²	140	131.5 Å²	131.5	75%	0.749	67%	0.674	S	S	*	*	S	Bend	trans	-112.3	13.1	-175.7	-83.2	-19.4	0	0	0	115.3
238	I	34.5	Very low	33.5	Very low	125 Å²	125	130.5 Å²	130.5	64%	0.641	68%	0.676	S	S	*	*	S	Bend	trans	-107.2	121.5	167.9	-58.8	176.9	0	0	0	107.2	S240	I238-S240 PolarHBondContact O-N 3.33Å
239	P	30.1	Very low	33.2	Very low	118 Å²	118	132.1 Å²	132.1	77%	0.766	68%	0.684	S	S	*	*			trans	-66.6	99	-179.7	24	-30.5	0	0	0	110.1	D241	P239-D241 PolarHBondContact O-N 2.72Å
240	S	27	Very low	32.7	Very low	113 Å²	113	134.3 Å²	134.3	79%	0.79	71%	0.705	S	S	*	*			trans	-77	44.2	-178	59.6	0	0	0	0	112.7	I238	I238-S240 PolarHBondContact O-N 3.33Å
241	D	28	Very low	32.4	Very low	138 Å²	138	136.2 Å²	136.2	74%	0.738	71%	0.714	S	S	*	*	S	Bend	trans	-149.7	117.5	179	-95.2	-46.2	0	0	0	111.7	P239	P239-D241 PolarHBondContact O-N 2.72Å
242	K	33.2	Very low	31.8	Very low	195 Å²	195	141.9 Å²	141.9	85%	0.848	73%	0.733	S	S	*	*	S	Bend	trans	122.6	-12.9	161.5	-68.4	168.4	178.9	171.9	0	119.1
243	I	29.3	Very low	31.3	Very low	153 Å²	153	144.8 Å²	144.8	79%	0.785	75%	0.749	S	S	*	*	S	Bend	trans	-105.6	-28	-172.5	-59.2	-177.7	0	0	0	114.7	T245	I243-T245 PolarHBondContact O-N 3.47Å
244	C	27.5	Very low	30.9	Very low	123 Å²	123	145.2 Å²	145.2	83%	0.831	76%	0.761	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.2	-3.2	-173.4	-82.2	0	0	0	0	117.2
245	T	31.1	Very low	30.4	Very low	126 Å²	126	148.8 Å²	148.8	77%	0.773	77%	0.774	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98	-0.1	-172.7	44.9	0	0	0	0	116	I243	I243-T245 PolarHBondContact O-N 3.47Å
246	K	31.6	Very low	30.2	Very low	197 Å²	197	147.8 Å²	147.8	86%	0.857	78%	0.782	S	S	*	*	S	Bend	trans	-102.7	3.4	-177.9	-80.7	-171.6	174.2	-178.5	0	116.7
247	L	30.4	Very low	29.9	Very low	158 Å²	158	146.5 Å²	146.5	83%	0.827	79%	0.788	S	S	*	*	S	Bend	trans	-106.9	2.3	-173.4	-91.1	159.1	0	0	0	116.1
248	N	29.9	Very low	29.7	Very low	152 Å²	152	146.5 Å²	146.5	81%	0.813	79%	0.788	S	S	*	*			trans	-112.2	15.5	-177	-79	-17.7	0	0	0	115
249	Q	30.5	Very low	29.6	Very low	166 Å²	166	149.6 Å²	149.6	78%	0.776	80%	0.8	S	S	*	*			trans	-95.5	120.3	173.9	-72.4	-168.1	-3.9	0	0	111.7	I251	Q249-I251 PolarHBondContact O-N 2.95Å; Q249-I251 VanDerWaalsContact O-N 3.17Å
250	P	26.3	Very low	29.8	Very low	123 Å²	123	149.2 Å²	149.2	80%	0.799	80%	0.8	S	S	*	*			trans	-74	105.1	170.5	30	-31.7	0	0	0	109.1	K252	P250-K252 PolarHBondContact O-N 3.04Å
251	I	29	Very low	29.9	Very low	149 Å²	149	151.4 Å²	151.4	76%	0.764	80%	0.803	S	S	*	*			trans	-69	102.1	178.1	-58.8	177.2	0	0	0	109	Q249 I253	Q249-I251 PolarHBondContact O-N 2.95Å; Q249-I251 VanDerWaalsContact O-N 3.17Å; I251-I253 PolarHBondContact O-N 3.14Å
252	K	26.9	Very low	30.2	Very low	188 Å²	188	154.1 Å²	154.1	82%	0.817	81%	0.811	S	S	*	*			trans	-63.2	118.3	161.3	-84.7	-177.4	173.4	179.3	0	108.1	P250	P250-K252 PolarHBondContact O-N 3.04Å
253	I	27.5	Very low	30.1	Very low	153 Å²	153	154.2 Å²	154.2	79%	0.785	81%	0.812	S	S	*	*			trans	-82.3	113	164.1	-57	173.3	0	0	0	106.1	I251	I251-I253 PolarHBondContact O-N 3.14Å
254	T	29.5	Very low	30.1	Very low	114 Å²	114	153.5 Å²	153.5	70%	0.699	81%	0.814	S	S	*	*			trans	-110.3	127.4	169.4	41.4	0	0	0	0	109.2
255	D	27.2	Very low	30.3	Very low	154 Å²	154	154.6 Å²	154.6	82%	0.824	81%	0.812	S	S	*	*			trans	-66.1	131.8	178.3	-54.5	-70	0	0	0	111.9
256	T	32.9	Very low	30.2	Very low	143 Å²	143	153.6 Å²	153.6	88%	0.877	81%	0.807	S	S	*	*			trans	-141.6	132.1	158	35.1	0	0	0	0	111.5
257	N	31	Very low	30.1	Very low	149 Å²	149	151.7 Å²	151.7	80%	0.797	81%	0.806	S	S	*	*			trans	-83.5	142.3	179.9	-85.8	-57.3	0	0	0	112.4
258	N	29.3	Very low	30.2	Very low	139 Å²	139	153.6 Å²	153.6	74%	0.743	81%	0.811	S	S	*	*			trans	55.3	153.1	139.1	-66.7	-35	0	0	0	122.4
259	Q	33.2	Very low	30.1	Very low	190 Å²	190	152 Å²	152	89%	0.888	81%	0.807	S	S	*	*			trans	76	134.1	171.6	-51.5	-177.7	9.3	0	0	113.9
260	S	34.9	Very low	30.1	Very low	111 Å²	111	151.4 Å²	151.4	78%	0.776	81%	0.808	S	S	*	*			cis	-159.2	170.4	-3.7	43.2	0	0	0	0	110.6
261	N	29.5	Very low	30.3	Very low	158 Å²	158	151.9 Å²	151.9	85%	0.845	80%	0.803	S	S	*	*			trans	-47	138.6	177	-54.5	-49.4	0	0	0	113.8
262	E	33.2	Very low	30.4	Very low	195 Å²	195	153.3 Å²	153.3	91%	0.911	80%	0.804	S	S	*	*				-157.7	159.7	116.6	-117.4	172.9	175	0	0	113.4
263	K	30.7	Very low	30.7	Very low	197 Å²	197	149.6 Å²	149.6	86%	0.857	80%	0.802	S	S	*	*			trans	-87.8	155.5	-178.7	-59.7	166.1	-179.8	170.2	0	109.2
264	V	30.2	Very low	31	Very low	139 Å²	139	150 Å²	150	84%	0.842	80%	0.8	S	S	*	*				177	127.1	117.6	151.3	0	0	0	0	112
265	N	31.1	Very low	31.3	Very low	146 Å²	146	150 Å²	150	78%	0.781	80%	0.804	S	S	*	*			trans	11.7	133.1	152	-140.4	23.7	0	0	0	122
266	P	29.7	Very low	31.5	Very low	104 Å²	104	149.7 Å²	149.7	68%	0.675	80%	0.803	S	S	*	*			trans	-94.1	125	164.4	35	-27.7	0	0	0	112.2
267	N	28.3	Very low	31.4	Very low	157 Å²	157	153.9 Å²	153.9	84%	0.84	80%	0.804	S	S	*	*			trans	163	108.1	145.5	-88.9	-17.2	0	0	0	109.6
268	E	33.4	Very low	31.4	Very low	198 Å²	198	151.8 Å²	151.8	93%	0.925	80%	0.801	S	S	*	*			trans	-162.1	135.4	141	-117.1	164.5	-159.4	0	0	112.2
269	T	28.2	Very low	31.5	Very low	120 Å²	120	150.8 Å²	150.8	74%	0.736	81%	0.805	S	S	*	*			trans	-84.2	176.1	175.2	29	0	0	0	0	112.3
270	L	30.8	Very low	31.4	Very low	152 Å²	152	146.3 Å²	146.3	80%	0.796	80%	0.795	S	S	*	*			trans	93.8	146.6	170.7	-69.6	104.3	0	0	0	115.5
271	I	30.4	Very low	31.2	Very low	134 Å²	134	145.9 Å²	145.9	69%	0.687	79%	0.792	S	S	*	*			cis	-180	142.9	-27.3	-113.3	170.8	0	0	0	104.8
272	K	31.2	Very low	31.3	Very low	179 Å²	179	147.8 Å²	147.8	78%	0.778	80%	0.795	S	S	*	*			trans	39.8	126	160.2	-68	176.1	176.2	-178.7	0	122.3
273	S	33.8	Very low	31.1	Very low	110 Å²	110	143.4 Å²	143.4	77%	0.769	79%	0.786	S	S	*	*				-175.4	118.5	113.1	40.7	0	0	0	0	109.5
274	H	32.1	Very low	31.2	Very low	162 Å²	162	139 Å²	139	75%	0.75	78%	0.781	S	S	*	*				59.5	107.6	90	-72.3	-69.3	0	0	0	116.1
275	S	36.1	Very low	31.2	Very low	113 Å²	113	139.5 Å²	139.5	79%	0.79	78%	0.777	S	S	*	*				-174.8	128	114.8	47.2	0	0	0	0	112.5
276	D	30.8	Very low	31.3	Very low	148 Å²	148	139.7 Å²	139.7	79%	0.791	78%	0.777	S	S	*	*			trans	-84.3	144.4	164.8	-57.2	-73.5	0	0	0	109.5
277	Y	32.3	Very low	31.3	Very low	231 Å²	231	141.9 Å²	141.9	91%	0.906	78%	0.783	S	S	*	*			trans	-141.9	123.6	160.3	-107.2	-83.5	0	0	0	111
278	S	29.4	Very low	31.4	Very low	104 Å²	104	143.8 Å²	143.8	73%	0.727	79%	0.787	S	S	*	*			trans	-92.4	-173.8	-175.8	-56.3	0	0	0	0	112.6
279	S	32.3	Very low	31.1	Very low	119 Å²	119	139.8 Å²	139.8	83%	0.832	78%	0.779	S	S	*	*			trans	83.3	145.4	168.7	86.4	0	0	0	0	114.1
280	S	31.5	Very low	31.3	Very low	96 Å²	96	140.6 Å²	140.6	67%	0.671	78%	0.784	S	S	*	*			cis	-178.7	116.2	-2.5	147.2	0	0	0	0	106
281	S	29.8	Very low	31.3	Very low	102 Å²	102	139 Å²	139	71%	0.713	78%	0.78	S	S	*	*			trans	30.5	135.7	140.7	65.6	0	0	0	0	122.4
282	E	33.1	Very low	31.5	Very low	197 Å²	197	140.1 Å²	140.1	92%	0.921	79%	0.788	S	S	*	*				-163.8	167.7	116.5	-112.4	173.1	-175.9	0	0	113
283	S	27.9	Very low	31.5	Very low	103 Å²	103	139.3 Å²	139.3	72%	0.72	79%	0.787	S	S	*	*			trans	-116.3	178.2	-165	55.9	0	0	0	0	113.8
284	S	33.2	Very low	31.5	Very low	106 Å²	106	140 Å²	140	74%	0.741	78%	0.782	S	S	*	*			trans	82.3	153.4	165.1	91.5	0	0	0	0	115.7
285	L	30.6	Very low	31.5	Very low	148 Å²	148	141.1 Å²	141.1	78%	0.775	78%	0.784	S	S	*	*			cis	-168.7	171	-15	-117.8	175.7	0	0	0	109.4
286	I	32.8	Very low	31.1	Very low	151 Å²	151	140 Å²	140	77%	0.774	78%	0.776	S	S	*	*			trans	82.2	134	153.6	-67.7	150	0	0	0	120.2
287	N	29.6	Very low	31.1	Very low	149 Å²	149	142 Å²	142	80%	0.797	78%	0.781	S	S	*	*			trans	-73.5	161.6	173.3	-52.1	-55.5	0	0	0	113
288	E	31.1	Very low	31	Very low	197 Å²	197	134.9 Å²	134.9	92%	0.921	78%	0.777	S	S	*	*				-156.8	160	120.3	-125.4	178.8	167.1	0	0	114.4
289	C	26	Very low	30.9	Very low	114 Å²	114	134.1 Å²	134.1	77%	0.77	78%	0.777	S	S	*	*			trans	-80.9	164.4	-175.3	-62.9	0	0	0	0	113
290	V	33.6	Very low	30.9	Very low	138 Å²	138	137 Å²	137	84%	0.836	78%	0.775	S	S	*	*				177.5	138.3	109.8	152.8	0	0	0	0	111.1
291	T	30.8	Very low	30.8	Very low	117 Å²	117	141.6 Å²	141.6	72%	0.718	78%	0.779	S	S	*	*			trans	-71.3	150	177.5	48.4	0	0	0	0	114.1
292	N	34.2	Very low	30.7	Very low	159 Å²	159	143.2 Å²	143.2	85%	0.85	78%	0.777	S	S	*	*			trans	-158.3	150.1	132.2	-112.6	-38.4	0	0	0	115.8
293	H	31.5	Very low	30.5	Very low	162 Å²	162	143.6 Å²	143.6	75%	0.75	77%	0.77	S	S	*	*			trans	-79.2	152.6	-175.1	-71.3	-90.1	0	0	0	114
294	N	33.8	Very low	30.4	Very low	124 Å²	124	148.3 Å²	148.3	66%	0.663	77%	0.772	S	S	*	*				174.5	133.8	102.3	-94.7	-64.4	0	0	0	114.9
295	K	30.7	Very low	30.3	Very low	185 Å²	185	150.9 Å²	150.9	80%	0.804	78%	0.778	S	S	*	*			trans	48.5	142.6	133	-66.5	173.3	-174.7	171.6	0	120.9
296	S	27.7	Very low	30.1	Very low	89 Å²	89	151.8 Å²	151.8	62%	0.622	78%	0.778	S	S	*	*			cis	-175.7	156.9	-2.8	51.3	0	0	0	0	114.5
297	H	30.6	Very low	30.1	Very low	191 Å²	191	150 Å²	150	88%	0.884	78%	0.779	S	S	*	*			trans	73.8	125	147.5	-67.6	-48.3	0	0	0	122.6
298	G	30.1	Very low	30	Very low	81 Å²	81	149.5 Å²	149.5	84%	0.835	78%	0.776	S	S	*	*			trans	178.2	38.4	168.7	0	0	0	0	0	113.3
299	A	27.5	Very low	30	Very low	88 Å²	88	148.4 Å²	148.4	73%	0.727	77%	0.774	S	S	*	*			trans	-77.8	160.5	-170.6	0	0	0	0	0	114.1
300	K	32.2	Very low	30.1	Very low	181 Å²	181	150.5 Å²	150.5	79%	0.787	77%	0.773	S	S	*	*			trans	-171.9	109.8	139.1	-101	-155.6	-176.4	177.5	0	114.8
301	Y	30.1	Very low	29.8	Very low	191 Å²	191	149.3 Å²	149.3	75%	0.749	77%	0.771	S	S	*	*			trans	59.5	150.1	156.2	-58.3	-100.5	0	0	0	118
302	M	27	Very low	29.8	Very low	137 Å²	137	152.8 Å²	152.8	68%	0.675	78%	0.776	S	S	*	*			cis	-171	157.4	-11.7	-101.2	-73	172	0	0	105.7
303	R	29.9	Very low	29.6	Very low	204 Å²	204	156.6 Å²	156.6	77%	0.77	78%	0.78	S	S	*	*			cis	-156.8	160.4	-6	-167.5	-169.3	-74.4	-179.3	-3	107.5
304	R	26.4	Very low	29.5	Very low	202 Å²	202	156 Å²	156	76%	0.762	79%	0.787	S	S	*	*			trans	-83.6	153.5	163.1	-85.1	-176.6	169.4	114.6	-1.4	112.2	E306	R304-E306 IonicContact NE-OE2 3.27Å
305	N	30.5	Very low	29.3	Very low	161 Å²	161	153.3 Å²	153.3	86%	0.861	79%	0.79	S	S	*	*			trans	-148.2	83	150.8	-101.5	8.3	0	0	0	107.8
306	E	25.5	Very low	29.3	Very low	166 Å²	166	155.7 Å²	155.7	78%	0.776	79%	0.794	S	S	*	*			trans	-98.9	129.3	157.2	-72.7	166	120.7	0	0	106.3	R304	R304-E306 IonicContact NE-OE2 3.27Å
307	S	33.5	Very low	29.6	Very low	115 Å²	115	159.6 Å²	159.6	80%	0.804	81%	0.806	S	S	*	*			trans	-132.3	122.6	171.5	58.6	0	0	0	0	109.5
308	L	27.5	Very low	29.6	Very low	138 Å²	138	154 Å²	154	72%	0.723	80%	0.801	S	S	*	*			trans	-39.6	148.4	174.2	-61.8	71.3	0	0	0	113.3
309	I	30.4	Very low	29.6	Very low	174 Å²	174	156.3 Å²	156.3	89%	0.892	80%	0.804	S	S	*	*				-144.9	117.3	121.7	-92.4	137.4	0	0	0	107.4
310	E	27.9	Very low	29.9	Very low	158 Å²	158	156.6 Å²	156.6	74%	0.738	80%	0.801	S	S	*	*			trans	-79.3	142.8	170.4	-72.5	172.6	108.4	0	0	110.9	K312	E310-K312 PolarHBondContact O-N 3.02Å
311	S	28.1	Very low	30.1	Very low	113 Å²	113	155 Å²	155	79%	0.79	80%	0.8	S	S	*	*			trans	-1	112.3	137.2	178.2	0	0	0	0	116.7
312	K	29.7	Very low	30.4	Very low	189 Å²	189	151.2 Å²	151.2	82%	0.822	79%	0.793	S	S	*	*			trans	-175.5	91.9	146.3	-105.6	161.4	-172.3	171.9	0	111.4	E310	E310-K312 PolarHBondContact O-N 3.02Å
313	Y	31.5	Very low	31.3	Very low	240 Å²	240	150 Å²	150	94%	0.941	80%	0.798	S	S	*	*			trans	-158.3	71.6	151.7	-102.1	-67.5	0	0	0	110.7
314	T	29.9	Very low	32.1	Very low	148 Å²	148	148.3 Å²	148.3	91%	0.908	80%	0.799	S	S	*	*			trans	-102.8	112	160.7	42.3	0	0	0	0	108.1
315	G	29.3	Very low	33	Very low	69 Å²	69	141 Å²	141	71%	0.711	78%	0.779	S	S	*	*			trans	167.1	82.6	177.5	0	0	0	0	0	119.2
316	R	30.4	Very low	33.7	Very low	235 Å²	235	138.4 Å²	138.4	89%	0.887	77%	0.765	S	S	*	*			trans	81.8	143.9	139.3	-141.8	173.6	-141.8	-120.7	1.2	118.7
317	L	33.6	Very low	34.8	Very low	170 Å²	170	137.7 Å²	137.7	89%	0.89	76%	0.76	S	S	*	*			trans	73.8	124.6	-179.2	-47.5	172.7	0	0	0	113.9
318	G	29.7	Very low	35.4	Very low	74 Å²	74	140.2 Å²	140.2	76%	0.763	76%	0.756	S	S	*	*			cis	154.5	108.1	-8.8	0	0	0	0	0	113.3
319	S	30.9	Very low	36.7	Very low	129 Å²	129	138.4 Å²	138.4	90%	0.902	75%	0.747	S	S	*	*			trans	78.1	139	165.8	-157.4	0	0	0	0	120
320	S	34.4	Very low	38.4	Very low	95 Å²	95	135 Å²	135	66%	0.664	73%	0.731	S	S	*	*	S	Bend	trans	78.5	109.4	168.2	-103.6	0	0	0	0	120.7
321	D	34.9	Very low	40.3	Very low	146 Å²	146	131.8 Å²	131.8	78%	0.781	72%	0.719	S	S	*	*			trans	58.3	69.1	135.2	-48.3	-42.6	0	0	0	119.9
322	D	38.4	Very low	42.1	Very low	112 Å²	112	132.9 Å²	132.9	60%	0.599	71%	0.71	S	S	*	*			trans	-146.8	59	169	-127.8	-31.6	0	0	0	112.9	S325	D322-S325 WeakPolarHBondContact OD1-CB 3.25Å; D322-S325 PolarHBondContact OD1-OG 3.36Å
323	S	44.6	Very low	44	Very low	112 Å²	112	128.9 Å²	128.9	78%	0.783	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.8	-12.5	-175.6	56.9	0	0	0	0	115
324	Q	46.7	Very low	45.9	Very low	168 Å²	168	120.5 Å²	120.5	79%	0.785	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.8	-36.8	176.7	-73	-168.4	-19.9	0	0	113.7	N326 K327 F328	Q324-N326 PolarHBondContact O-N 3.35Å; Q324-K327 PolarHBondContact O-N 2.93Å; Q324-F328 PolarHBondContact O-N 3.21Å
325	S	44.7	Very low	48.2	Very low	48 Å²	48	120.4 Å²	120.4	34%	0.336	66%	0.66	S	S	.	*	H	α-helix	trans	-63.9	-40	-176.2	57.4	0	0	0	0	113.2	D322 K327 F328 N329	D322-S325 WeakPolarHBondContact OD1-CB 3.25Å; D322-S325 PolarHBondContact OD1-OG 3.36Å; S325-K327 VanDerWaalsContact C-N 3.31Å; S325-K327 PolarHBondContact O-N 3.39Å; S325-F328 PolarHBondContact O-N 2.99Å; S325-N329 PolarHBondContact O-N 2.86Å
326	N	46.2	Very low	50.3	Low	108 Å²	108	123.8 Å²	123.8	58%	0.578	65%	0.651	S	S	*	*	H	α-helix	trans	-67.6	-25.5	176.3	-90.3	-38.4	0	0	0	114	Q324 N330	Q324-N326 PolarHBondContact O-N 3.35Å; N326-N330 PolarHBondContact O-N 3.43Å; N326-N330 PolarHBondContact O-ND2 3.48Å; N326-N330 VanDerWaalsContact O-ND2 3.07Å
327	K	49	Very low	52.5	Low	151 Å²	151	116.5 Å²	116.5	66%	0.657	64%	0.637	S	S	*	*	H	α-helix	trans	-74.8	-42.1	178.3	-156.3	176.1	-176.9	-174.6	0	110.9	Q324 S325 N329 N330 D331	Q324-K327 PolarHBondContact O-N 2.93Å; S325-K327 VanDerWaalsContact C-N 3.31Å; S325-K327 PolarHBondContact O-N 3.39Å; K327-N329 PolarHBondContact O-N 2.76Å; K327-N330 PolarHBondContact O-N 2.98Å; K327-D331 PolarHBondContact O-N 3.4Å; K327-D331 VanDerWaalsContact O-N 3.13Å
328	F	45.1	Very low	54.7	Low	168 Å²	168	112 Å²	112	74%	0.737	62%	0.62	S	S	*	*	H	α-helix	trans	-64.6	-40.4	179.6	-142.4	-85.3	0	0	0	112.9	Q324 S325 F332	Q324-F328 PolarHBondContact O-N 3.21Å; S325-F328 PolarHBondContact O-N 2.99Å; F328-F332 PolarHBondContact O-N 3.43Å; F328-F332 VanDerWaalsContact O-N 3.09Å
329	N	56.2	Low	56.9	Low	99 Å²	99	112 Å²	112	53%	0.529	60%	0.602	S	S	.	*	H	α-helix	trans	-65.8	-38.6	176.1	-85.2	-25.7	0	0	0	112.8	S325 K327 F332 L333	S325-N329 PolarHBondContact O-N 2.86Å; K327-N329 PolarHBondContact O-N 2.76Å; N329-F332 PolarHBondContact O-N 2.98Å; N329-L333 WeakPolarHBondContact O-CB 3.45Å; N329-L333 VanDerWaalsContact O-CG 3.3Å; N329-L333 WeakPolarHBondContact O-CG 3.25Å; N329-L333 PolarHBondContact O-N 3.12Å
330	N	64.2	Low	59	Low	103 Å²	103	110.3 Å²	110.3	55%	0.551	58%	0.579	S	S	*	*	H	α-helix	trans	-68.7	-39.2	178.2	-76.3	-32.4	0	0	0	112.4	N326 K327 L333 S334	N326-N330 PolarHBondContact O-N 3.43Å; N326-N330 PolarHBondContact O-ND2 3.48Å; N326-N330 VanDerWaalsContact O-ND2 3.07Å; K327-N330 PolarHBondContact O-N 2.98Å; N330-L333 PolarHBondContact O-N 3.06Å; N330-S334 WeakPolarHBondContact O-CB 3.35Å; N330-S334 PolarHBondContact O-N 2.94Å; N330-S334 PolarHBondContact O-OG 3.4Å
331	D	67.8	Low	61.3	Low	91 Å²	91	111.2 Å²	111.2	49%	0.487	57%	0.573	S	S	.	*	H	α-helix	trans	-70.1	-31.3	176.1	-76.9	-16.9	0	0	0	112.9	K327 S334 K335	K327-D331 PolarHBondContact O-N 3.4Å; K327-D331 VanDerWaalsContact O-N 3.13Å; D331-S334 PolarHBondContact O-OG 3.35Å; D331-S334 VanDerWaalsContact O-OG 3.08Å; D331-K335 WeakPolarHBondContact O-CB 3.27Å; D331-K335 WeakPolarHBondContact O-CG 3.42Å; D331-K335 PolarHBondContact O-N 3.3Å
332	F	67.9	Low	63.4	Low	136 Å²	136	109.9 Å²	109.9	60%	0.596	56%	0.562	S	S	*	*	H	α-helix	trans	-70.7	-43	173.1	-169.7	-93.7	0	0	0	111.8	F328 N329 W336	F328-F332 PolarHBondContact O-N 3.43Å; F328-F332 VanDerWaalsContact O-N 3.09Å; N329-F332 PolarHBondContact O-N 2.98Å; F332-W336 WeakPolarHBondContact O-CB 3.46Å; F332-W336 PolarHBondContact O-N 3.01Å
333	L	69.4	Low	65.4	Low	104 Å²	104	108.7 Å²	108.7	55%	0.545	56%	0.555	S	S	.	*	H	α-helix	trans	-65.9	-38.4	177.5	-73.8	168.7	0	0	0	112.6	N329 N330 W336 S337	N329-L333 WeakPolarHBondContact O-CB 3.45Å; N329-L333 VanDerWaalsContact O-CG 3.3Å; N329-L333 WeakPolarHBondContact O-CG 3.25Å; N329-L333 PolarHBondContact O-N 3.12Å; N330-L333 PolarHBondContact O-N 3.06Å; L333-W336 PolarHBondContact O-N 3.2Å; L333-S337 PolarHBondContact O-N 3.34Å
334	S	71.4	Confident	67.1	Low	64 Å²	64	109.4 Å²	109.4	45%	0.448	55%	0.546	S	S	.	.	H	α-helix	trans	-66.3	-45.6	176.9	69.2	0	0	0	0	111.8	N330 D331 W336 S337 S338	N330-S334 WeakPolarHBondContact O-CB 3.35Å; N330-S334 PolarHBondContact O-N 2.94Å; N330-S334 PolarHBondContact O-OG 3.4Å; D331-S334 PolarHBondContact O-OG 3.35Å; D331-S334 VanDerWaalsContact O-OG 3.08Å; S334-W336 PolarHBondContact O-N 2.98Å; S334-S337 PolarHBondContact O-N 3Å; S334-S338 PolarHBondContact O-N 3.05Å
335	K	76.5	Confident	68.7	Low	146 Å²	146	105.7 Å²	105.7	64%	0.635	53%	0.529	S	S	*	.	H	α-helix	trans	-61.1	-42.2	173.7	-75.2	179.3	177.9	179	0	112.2	D331 S338 I339	D331-K335 WeakPolarHBondContact O-CB 3.27Å; D331-K335 WeakPolarHBondContact O-CG 3.42Å; D331-K335 PolarHBondContact O-N 3.3Å; K335-S338 PolarHBondContact O-N 3Å; K335-I339 WeakPolarHBondContact O-CG1 3.46Å; K335-I339 PolarHBondContact O-N 2.99Å
336	W	73.7	Confident	70.1	Confident	140 Å²	140	107.9 Å²	107.9	53%	0.53	54%	0.537	S	S	.	.	H	α-helix	trans	-63.7	-43	177.3	-171.3	-103.6	0	0	0	112.4	F332 L333 S334 S338 I339 Q340	F332-W336 WeakPolarHBondContact O-CB 3.46Å; F332-W336 PolarHBondContact O-N 3.01Å; L333-W336 PolarHBondContact O-N 3.2Å; S334-W336 PolarHBondContact O-N 2.98Å; W336-S338 PolarHBondContact O-N 3.36Å; W336-I339 PolarHBondContact O-N 3.05Å; W336-Q340 WeakPolarHBondContact O-CG 3.17Å; W336-Q340 PolarHBondContact O-N 2.96Å
337	S	78	Confident	71.7	Confident	83 Å²	83	109.4 Å²	109.4	58%	0.58	54%	0.538	S	S	*	.	H	α-helix	trans	-61.1	-41	173	-83	0	0	0	0	112.6	L333 S334 Q340 H341	L333-S337 PolarHBondContact O-N 3.34Å; S334-S337 PolarHBondContact O-N 3Å; S337-Q340 PolarHBondContact O-N 3.17Å; S337-H341 PolarHBondContact O-N 3.08Å
338	S	79.2	Confident	73	Confident	76 Å²	76	105.5 Å²	105.5	53%	0.531	53%	0.529	S	S	.	.	H	α-helix	trans	-61.4	-45.5	176.2	-162.9	0	0	0	0	111.6	S334 K335 W336 Q340 H341 E342	S334-S338 PolarHBondContact O-N 3.05Å; K335-S338 PolarHBondContact O-N 3Å; W336-S338 PolarHBondContact O-N 3.36Å; S338-Q340 VanDerWaalsContact C-N 3.34Å; S338-Q340 PolarHBondContact O-N 3.31Å; S338-H341 PolarHBondContact O-N 3.38Å; S338-E342 WeakPolarHBondContact O-CB 3.49Å; S338-E342 PolarHBondContact O-N 3.23Å
339	I	76.3	Confident	74.5	Confident	74 Å²	74	102.8 Å²	102.8	38%	0.379	52%	0.519	S	S	.	.	H	α-helix	trans	-64.2	-37.1	177.5	-68.4	165.2	0	0	0	111.4	K335 W336 N343	K335-I339 WeakPolarHBondContact O-CG1 3.46Å; K335-I339 PolarHBondContact O-N 2.99Å; W336-I339 PolarHBondContact O-N 3.05Å; I339-N343 WeakPolarHBondContact CG2-ND2 3.43Å; I339-N343 WeakPolarHBondContact O-CB 3.28Å; I339-N343 PolarHBondContact O-N 3.4Å; I339-N343 PolarHBondContact O-ND2 2.9Å
340	Q	74.3	Confident	75.4	Confident	93 Å²	93	102.5 Å²	102.5	44%	0.435	52%	0.516	S	S	.	.	H	α-helix	trans	-65.6	-44.7	174.5	-70.4	-62.6	-33.5	0	0	111.4	W336 S337 S338 E342 N343 E344	W336-Q340 WeakPolarHBondContact O-CG 3.17Å; W336-Q340 PolarHBondContact O-N 2.96Å; S337-Q340 PolarHBondContact O-N 3.17Å; S338-Q340 VanDerWaalsContact C-N 3.34Å; S338-Q340 PolarHBondContact O-N 3.31Å; Q340-E342 PolarHBondContact O-N 3.22Å; Q340-N343 PolarHBondContact O-N 2.91Å; Q340-E344 WeakPolarHBondContact O-CB 3.37Å; Q340-E344 PolarHBondContact O-N 2.65Å
341	H	81.9	Confident	76	Confident	113 Å²	113	102 Å²	102	52%	0.523	51%	0.514	S	S	.	.	H	α-helix	trans	-61.9	-43.3	177.7	-171.7	62.5	0	0	0	112.4	S337 S338 E344 Q345	S337-H341 PolarHBondContact O-N 3.08Å; S338-H341 PolarHBondContact O-N 3.38Å; H341-E344 PolarHBondContact O-N 3.36Å; H341-Q345 PolarHBondContact NE2-NE2 3.38Å; H341-Q345 PolarHBondContact O-N 3.49Å
342	E	80.3	Confident	76.5	Confident	119 Å²	119	104.3 Å²	104.3	56%	0.556	52%	0.522	S	S	*	.	H	α-helix	trans	-64.4	-43.1	177.2	-169.3	177	-155.4	0	0	112	S338 Q340 E344 Q345 L346	S338-E342 WeakPolarHBondContact O-CB 3.49Å; S338-E342 PolarHBondContact O-N 3.23Å; Q340-E342 PolarHBondContact O-N 3.22Å; E342-E344 VanDerWaalsContact C-N 3.27Å; E342-E344 PolarHBondContact O-N 3.31Å; E342-Q345 PolarHBondContact O-N 2.91Å; E342-L346 WeakPolarHBondContact O-CG 3.45Å; E342-L346 PolarHBondContact O-N 3.48Å
343	N	79.4	Confident	76.6	Confident	86 Å²	86	102.4 Å²	102.4	46%	0.46	52%	0.516	S	S	.	.	H	α-helix	trans	-60.5	-36.5	172.4	-85.6	-71.2	0	0	0	112.5	I339 Q340 K347	I339-N343 WeakPolarHBondContact CG2-ND2 3.43Å; I339-N343 WeakPolarHBondContact O-CB 3.28Å; I339-N343 PolarHBondContact O-N 3.4Å; I339-N343 PolarHBondContact O-ND2 2.9Å; Q340-N343 PolarHBondContact O-N 2.91Å; N343-K347 WeakPolarHBondContact O-CB 3.08Å; N343-K347 PolarHBondContact O-N 3.2Å
344	E	81	Confident	76.8	Confident	128 Å²	128	101.1 Å²	101.1	60%	0.598	51%	0.51	S	S	*	.	H	α-helix	trans	-72.5	-39.2	179.4	-159.6	147.4	-126	0	0	111.6	Q340 H341 E342 K347 C348	Q340-E344 WeakPolarHBondContact O-CB 3.37Å; Q340-E344 PolarHBondContact O-N 2.65Å; H341-E344 PolarHBondContact O-N 3.36Å; E342-E344 VanDerWaalsContact C-N 3.27Å; E342-E344 PolarHBondContact O-N 3.31Å; E344-K347 WeakPolarHBondContact O-CB 3.28Å; E344-K347 PolarHBondContact O-N 3.46Å; E344-C348 PolarHBondContact O-N 3.41Å; E344-C348 PolarHBondContact O-SG 3.36Å
345	Q	80	Confident	77	Confident	89 Å²	89	101.6 Å²	101.6	42%	0.416	51%	0.513	S	S	.	.	H	α-helix	trans	-61.2	-46.7	169.6	-70.2	-165	20.8	0	0	112.5	H341 E342 K347 C348 Q349	H341-Q345 PolarHBondContact NE2-NE2 3.38Å; H341-Q345 PolarHBondContact O-N 3.49Å; E342-Q345 PolarHBondContact O-N 2.91Å; Q345-K347 PolarHBondContact O-N 2.72Å; Q345-C348 WeakPolarHBondContact O-CB 3.39Å; Q345-C348 PolarHBondContact O-N 3.48Å; Q345-C348 VanDerWaalsContact O-N 3.09Å; Q345-Q349 WeakPolarHBondContact O-CG 3.31Å; Q345-Q349 PolarHBondContact O-N 3.02Å
346	L	74.4	Confident	76.9	Confident	95 Å²	95	99.9 Å²	99.9	50%	0.497	51%	0.506	S	S	.	.	H	α-helix	trans	-59	-35.7	176.1	-73.8	170.8	0	0	0	111.9	E342 Q349 L350	E342-L346 WeakPolarHBondContact O-CG 3.45Å; E342-L346 PolarHBondContact O-N 3.48Å; L346-Q349 PolarHBondContact O-N 2.99Å; L346-L350 WeakPolarHBondContact O-CB 3.4Å; L346-L350 PolarHBondContact O-N 3.06Å
347	K	79.4	Confident	76.7	Confident	139 Å²	139	100.7 Å²	100.7	60%	0.604	51%	0.509	S	S	*	.	H	α-helix	trans	-66.5	-39.5	175.3	-142.8	172.7	-172.4	175.9	0	112.1	N343 E344 Q345 N351	N343-K347 WeakPolarHBondContact O-CB 3.08Å; N343-K347 PolarHBondContact O-N 3.2Å; E344-K347 WeakPolarHBondContact O-CB 3.28Å; E344-K347 PolarHBondContact O-N 3.46Å; Q345-K347 PolarHBondContact O-N 2.72Å; K347-N351 VanDerWaalsContact O-CG 3.25Å; K347-N351 PolarHBondContact O-N 3.48Å; K347-N351 VanDerWaalsContact O-N 3.1Å; K347-N351 PolarHBondContact O-ND2 3.43Å
348	C	77.1	Confident	76.6	Confident	70 Å²	70	103.6 Å²	103.6	47%	0.473	51%	0.513	S	S	.	.	H	α-helix	trans	-64.9	-48.5	173	-71.1	0	0	0	0	111.6	E344 Q345 L350 N351 E352	E344-C348 PolarHBondContact O-N 3.41Å; E344-C348 PolarHBondContact O-SG 3.36Å; Q345-C348 WeakPolarHBondContact O-CB 3.39Å; Q345-C348 PolarHBondContact O-N 3.48Å; Q345-C348 VanDerWaalsContact O-N 3.09Å; C348-L350 VanDerWaalsContact C-N 3.31Å; C348-L350 PolarHBondContact O-N 3.33Å; C348-N351 WeakPolarHBondContact O-CB 3.44Å; C348-N351 PolarHBondContact O-N 3.3Å; C348-N351 VanDerWaalsContact O-N 3.07Å; C348-E352 PolarHBondContact O-N 3.02Å
349	Q	76.3	Confident	76.6	Confident	111 Å²	111	104.7 Å²	104.7	52%	0.519	51%	0.51	S	S	.	.	H	α-helix	trans	-59.2	-40	176.5	-68.4	179	5.6	0	0	112.4	Q345 L346 N351 E352 M353	Q345-Q349 WeakPolarHBondContact O-CG 3.31Å; Q345-Q349 PolarHBondContact O-N 3.02Å; L346-Q349 PolarHBondContact O-N 2.99Å; Q349-N351 VanDerWaalsContact C-N 3.34Å; Q349-N351 PolarHBondContact O-N 3.38Å; Q349-E352 PolarHBondContact O-N 2.91Å; Q349-M353 WeakPolarHBondContact O-CB 3.33Å; Q349-M353 PolarHBondContact O-N 3.28Å
350	L	74.4	Confident	76.4	Confident	92 Å²	92	106.9 Å²	106.9	48%	0.482	52%	0.517	S	S	.	.	H	α-helix	trans	-63.5	-39.2	175.2	-169.4	72.1	0	0	0	111.9	L346 C348 M353 N354	L346-L350 WeakPolarHBondContact O-CB 3.4Å; L346-L350 PolarHBondContact O-N 3.06Å; C348-L350 VanDerWaalsContact C-N 3.31Å; C348-L350 PolarHBondContact O-N 3.33Å; L350-M353 HydrophobicContact CD1-CE 3.9Å; L350-N354 WeakPolarHBondContact O-CB 3.47Å; L350-N354 PolarHBondContact O-N 2.9Å; L350-N354 PolarHBondContact O-ND2 2.95Å; L350-N354 VanDerWaalsContact O-ND2 3.15Å
351	N	77.5	Confident	76.2	Confident	92 Å²	92	106.7 Å²	106.7	49%	0.492	52%	0.516	S	S	.	.	H	α-helix	trans	-69.9	-38.5	176.5	-72.5	-25.7	0	0	0	112.6	K347 C348 Q349 N354 S355	K347-N351 VanDerWaalsContact O-CG 3.25Å; K347-N351 PolarHBondContact O-N 3.48Å; K347-N351 VanDerWaalsContact O-N 3.1Å; K347-N351 PolarHBondContact O-ND2 3.43Å; C348-N351 WeakPolarHBondContact O-CB 3.44Å; C348-N351 PolarHBondContact O-N 3.3Å; C348-N351 VanDerWaalsContact O-N 3.07Å; Q349-N351 VanDerWaalsContact C-N 3.34Å; Q349-N351 PolarHBondContact O-N 3.38Å; N351-N354 PolarHBondContact O-N 3.31Å; N351-S355 WeakPolarHBondContact O-CB 3.44Å; N351-S355 PolarHBondContact O-N 2.93Å; N351-S355 PolarHBondContact O-OG 3.35Å
352	E	77.8	Confident	75.9	Confident	140 Å²	140	107.9 Å²	107.9	65%	0.654	52%	0.52	S	S	*	.	H	α-helix	trans	-63.8	-46.7	172.8	-72.6	-179.1	179.5	0	0	111.4	C348 Q349 N354 S355 F356	C348-E352 PolarHBondContact O-N 3.02Å; Q349-E352 PolarHBondContact O-N 2.91Å; E352-N354 PolarHBondContact O-N 3.29Å; E352-S355 WeakPolarHBondContact O-CB 3.42Å; E352-S355 PolarHBondContact O-N 3.44Å; E352-F356 PolarHBondContact O-N 3Å
353	M	70.4	Confident	75.8	Confident	97 Å²	97	108.4 Å²	108.4	48%	0.478	52%	0.52	S	S	.	.	H	α-helix	trans	-61.3	-43.3	176.4	-175.5	176.9	63.3	0	0	111.7	Q349 L350 S355 F356 W357	Q349-M353 WeakPolarHBondContact O-CB 3.33Å; Q349-M353 PolarHBondContact O-N 3.28Å; L350-M353 HydrophobicContact CD1-CE 3.9Å; M353-S355 VanDerWaalsContact C-N 3.35Å; M353-S355 PolarHBondContact O-N 2.88Å; M353-F356 PolarHBondContact O-N 2.9Å; M353-W357 PolarHBondContact O-N 2.87Å
354	N	74.2	Confident	75.3	Confident	77 Å²	77	108.3 Å²	108.3	41%	0.412	52%	0.519	S	S	.	.	H	α-helix	trans	-60.7	-43.7	174.2	-75.9	-28.6	0	0	0	111.7	L350 N351 E352 F356 W357 E358	L350-N354 WeakPolarHBondContact O-CB 3.47Å; L350-N354 PolarHBondContact O-N 2.9Å; L350-N354 PolarHBondContact O-ND2 2.95Å; L350-N354 VanDerWaalsContact O-ND2 3.15Å; N351-N354 PolarHBondContact O-N 3.31Å; E352-N354 PolarHBondContact O-N 3.29Å; N354-F356 PolarHBondContact O-N 3.48Å; N354-W357 PolarHBondContact O-N 3.02Å; N354-E358 WeakPolarHBondContact O-CG 3.4Å; N354-E358 PolarHBondContact O-N 3.3Å
355	S	74.2	Confident	74.8	Confident	74 Å²	74	103.8 Å²	103.8	52%	0.517	50%	0.498	S	S	.	.	H	α-helix	trans	-62.1	-41.4	178	-57.6	0	0	0	0	112.1	N351 E352 M353 E358 E359	N351-S355 WeakPolarHBondContact O-CB 3.44Å; N351-S355 PolarHBondContact O-N 2.93Å; N351-S355 PolarHBondContact O-OG 3.35Å; E352-S355 WeakPolarHBondContact O-CB 3.42Å; E352-S355 PolarHBondContact O-N 3.44Å; M353-S355 VanDerWaalsContact C-N 3.35Å; M353-S355 PolarHBondContact O-N 2.88Å; S355-E358 PolarHBondContact O-N 2.98Å; S355-E359 PolarHBondContact O-N 3.47Å
356	F	74.8	Confident	74.6	Confident	110 Å²	110	102.9 Å²	102.9	48%	0.482	50%	0.496	S	S	.	.	H	α-helix	trans	-61.9	-43.9	174.1	174.7	-96.5	0	0	0	112.4	E352 M353 N354 E359 K360	E352-F356 PolarHBondContact O-N 3Å; M353-F356 PolarHBondContact O-N 2.9Å; N354-F356 PolarHBondContact O-N 3.48Å; F356-E359 PolarHBondContact O-N 3.25Å; F356-K360 HydrophobicContact CD1-CG 4.49Å; F356-K360 HydrophobicContact CE1-CG 4.08Å; F356-K360 HydrophobicContact CZ-CG 4.12Å; F356-K360 WeakPolarHBondContact O-CB 3.35Å; F356-K360 PolarHBondContact O-N 3.37Å
357	W	70.4	Confident	74.4	Confident	156 Å²	156	103.4 Å²	103.4	59%	0.591	50%	0.495	S	S	*	.	H	α-helix	trans	-67.5	-38.2	176.6	-77.5	115.5	0	0	0	112.7	M353 N354 K360 Q361	M353-W357 PolarHBondContact O-N 2.87Å; N354-W357 PolarHBondContact O-N 3.02Å; W357-K360 PolarHBondContact O-N 3.29Å; W357-Q361 VanDerWaalsContact O-CB 3.29Å; W357-Q361 WeakPolarHBondContact O-CB 3.37Å; W357-Q361 PolarHBondContact O-N 3Å
358	E	75.9	Confident	73.8	Confident	144 Å²	144	97 Å²	97	67%	0.673	47%	0.468	S	S	*	.	H	α-helix	trans	-62.8	-40.4	172.7	-74.2	-164.7	164.5	0	0	112	N354 S355 Q361 K362	N354-E358 WeakPolarHBondContact O-CG 3.4Å; N354-E358 PolarHBondContact O-N 3.3Å; S355-E358 PolarHBondContact O-N 2.98Å; E358-Q361 PolarHBondContact O-N 3.47Å; E358-K362 WeakPolarHBondContact O-CB 3.49Å; E358-K362 PolarHBondContact O-N 3.46Å
359	E	78.6	Confident	73.6	Confident	100 Å²	100	101.2 Å²	101.2	47%	0.467	47%	0.474	S	S	.	.	H	α-helix	trans	-67.1	-44.9	176.4	-159.3	-159.9	147.2	0	0	112.1	S355 F356 Q361 K362 K363	S355-E359 PolarHBondContact O-N 3.47Å; F356-E359 PolarHBondContact O-N 3.25Å; E359-Q361 PolarHBondContact O-N 2.94Å; E359-K362 PolarHBondContact O-N 3.15Å; E359-K363 WeakPolarHBondContact O-CG 3.46Å; E359-K363 PolarHBondContact O-N 3.43Å; E359-K363 WeakPolarHBondContact OE1-CE 3.19Å; E359-K363 IonicContact OE1-NZ 3Å; E359-K363 PolarHBondContact OE1-NZ 2.93Å
360	K	72.1	Confident	73.5	Confident	119 Å²	119	101.7 Å²	101.7	52%	0.517	48%	0.48	S	S	.	.	H	α-helix	trans	-57.4	-46.2	172.4	-87	-99.6	-172.8	166.2	0	111.3	F356 W357 K363 L364	F356-K360 HydrophobicContact CD1-CG 4.49Å; F356-K360 HydrophobicContact CE1-CG 4.08Å; F356-K360 HydrophobicContact CZ-CG 4.12Å; F356-K360 WeakPolarHBondContact O-CB 3.35Å; F356-K360 PolarHBondContact O-N 3.37Å; W357-K360 PolarHBondContact O-N 3.29Å; K360-K363 PolarHBondContact O-N 3.31Å; K360-L364 PolarHBondContact O-N 3.34Å
361	Q	69.2	Low	73.1	Confident	90 Å²	90	100.6 Å²	100.6	42%	0.421	47%	0.474	S	S	.	.	H	α-helix	trans	-63.3	-42.2	177.5	-179	174	-7.7	0	0	111.6	W357 E358 E359 L364 E365	W357-Q361 VanDerWaalsContact O-CB 3.29Å; W357-Q361 WeakPolarHBondContact O-CB 3.37Å; W357-Q361 PolarHBondContact O-N 3Å; E358-Q361 PolarHBondContact O-N 3.47Å; E359-Q361 PolarHBondContact O-N 2.94Å; Q361-L364 PolarHBondContact O-N 3.18Å; Q361-E365 PolarHBondContact NE2-OE1 3Å; Q361-E365 WeakPolarHBondContact O-CG 3.3Å; Q361-E365 PolarHBondContact O-N 3Å
362	K	77.3	Confident	72.7	Confident	138 Å²	138	98.7 Å²	98.7	60%	0.6	47%	0.468	S	S	*	.	H	α-helix	trans	-62	-45.1	176.8	-173.6	179.6	177.2	-174.4	0	111.9	E358 E359 L364 E365 D366	E358-K362 WeakPolarHBondContact O-CB 3.49Å; E358-K362 PolarHBondContact O-N 3.46Å; E359-K362 PolarHBondContact O-N 3.15Å; K362-L364 VanDerWaalsContact C-N 3.32Å; K362-L364 PolarHBondContact O-N 2.93Å; K362-E365 PolarHBondContact O-N 3.44Å; K362-D366 PolarHBondContact O-N 2.89Å
363	K	76.6	Confident	72.3	Confident	130 Å²	130	94.8 Å²	94.8	57%	0.565	46%	0.459	S	S	*	.	H	α-helix	trans	-59.3	-40.7	174.5	-76.9	169.9	170.1	166.9	0	112.1	E359 K360 H367	E359-K363 WeakPolarHBondContact O-CG 3.46Å; E359-K363 PolarHBondContact O-N 3.43Å; E359-K363 WeakPolarHBondContact OE1-CE 3.19Å; E359-K363 IonicContact OE1-NZ 3Å; E359-K363 PolarHBondContact OE1-NZ 2.93Å; K360-K363 PolarHBondContact O-N 3.31Å; K363-H367 WeakPolarHBondContact O-CB 3.4Å; K363-H367 PolarHBondContact O-N 3.44Å
364	L	68.8	Low	72.2	Confident	84 Å²	84	96.7 Å²	96.7	44%	0.44	46%	0.461	S	S	.	.	H	α-helix	trans	-66.9	-43	175.2	-175.8	65.1	0	0	0	112.3	K360 Q361 K362 D366 H367 C368	K360-L364 PolarHBondContact O-N 3.34Å; Q361-L364 PolarHBondContact O-N 3.18Å; K362-L364 VanDerWaalsContact C-N 3.32Å; K362-L364 PolarHBondContact O-N 2.93Å; L364-D366 PolarHBondContact O-N 3.44Å; L364-H367 PolarHBondContact O-N 3.23Å; L364-C368 WeakPolarHBondContact O-CB 3.38Å; L364-C368 PolarHBondContact O-N 3.23Å; L364-C368 PolarHBondContact O-SG 2.94Å
365	E	71.8	Confident	71.7	Confident	33 Å²	33	94.3 Å²	94.3	15%	0.154	45%	0.448	C	S	.	.	H	α-helix	trans	-61.2	-42.9	176	-78	178.3	-160.6	0	0	111.7	Q361 K362 C368 R369 K404	Q361-E365 PolarHBondContact NE2-OE1 3Å; Q361-E365 WeakPolarHBondContact O-CG 3.3Å; Q361-E365 PolarHBondContact O-N 3Å; K362-E365 PolarHBondContact O-N 3.44Å; E365-C368 PolarHBondContact O-N 3.43Å; E365-R369 VanDerWaalsContact O-CG 3.32Å; E365-R369 WeakPolarHBondContact O-CG 3.34Å; E365-R369 PolarHBondContact O-N 3.47Å; E365-K404 WeakPolarHBondContact OE1-CE 3.29Å; E365-K404 IonicContact OE1-NZ 2.86Å; E365-K404 PolarHBondContact OE1-NZ 2.95Å; E365-K404 IonicContact OE2-NZ 2.66Å; E365-K404 PolarHBondContact OE2-NZ 3.32Å
366	D	76	Confident	71.4	Confident	70 Å²	70	98.5 Å²	98.5	37%	0.374	46%	0.457	S	S	.	.	H	α-helix	trans	-69.1	-37.8	177.1	-73.5	-30.7	0	0	0	112.5	K362 L364 C368 R369 L370	K362-D366 PolarHBondContact O-N 2.89Å; L364-D366 PolarHBondContact O-N 3.44Å; D366-C368 VanDerWaalsContact C-N 3.35Å; D366-C368 PolarHBondContact O-N 3.25Å; D366-R369 WeakPolarHBondContact O-CB 3.29Å; D366-R369 PolarHBondContact O-N 3.49Å; D366-R369 IonicContact OD1-CZ 2.76Å; D366-R369 IonicContact OD1-NE 3.36Å; D366-R369 IonicContact OD1-NH1 2.65Å; D366-R369 PolarHBondContact OD1-NH1 3.48Å; D366-L370 PolarHBondContact O-N 2.91Å
367	H	70.5	Confident	71	Confident	105 Å²	105	99.6 Å²	99.6	49%	0.486	46%	0.459	S	S	.	.	H	α-helix	trans	-61.8	-42.1	171.7	-168.4	83.5	0	0	0	111.8	K363 L364 R369 L370 L371	K363-H367 WeakPolarHBondContact O-CB 3.4Å; K363-H367 PolarHBondContact O-N 3.44Å; L364-H367 PolarHBondContact O-N 3.23Å; H367-R369 PolarHBondContact O-N 3.36Å; H367-L370 WeakPolarHBondContact O-CB 3.49Å; H367-L370 PolarHBondContact O-N 2.88Å; H367-L371 WeakPolarHBondContact O-CG 3.45Å; H367-L371 PolarHBondContact O-N 3.49Å
368	C	66.8	Low	70.5	Confident	6 Å²	6	96.3 Å²	96.3	4%	0.041	45%	0.451	C	S	.	.	H	α-helix	trans	-69.1	-31.2	177.1	-65.5	0	0	0	0	113	L364 E365 D366 S372 L397 V401	L364-C368 WeakPolarHBondContact O-CB 3.38Å; L364-C368 PolarHBondContact O-N 3.23Å; L364-C368 PolarHBondContact O-SG 2.94Å; E365-C368 PolarHBondContact O-N 3.43Å; D366-C368 VanDerWaalsContact C-N 3.35Å; D366-C368 PolarHBondContact O-N 3.25Å; C368-S372 VanDerWaalsContact O-CB 3.29Å; C368-S372 WeakPolarHBondContact O-CB 3.34Å; C368-S372 PolarHBondContact O-N 3.34Å; C368-S372 PolarHBondContact O-OG 2.96Å; C368-L397 HydrophobicContact CB-CD2 4.06Å; C368-V401 HydrophobicContact CB-CG2 3.35Å; C368-V401 VanDerWaalsContact SG-CG2 3.51Å
369	R	72.4	Confident	69.6	Low	157 Å²	157	94.6 Å²	94.6	59%	0.592	44%	0.442	S	S	*	.	H	α-helix	trans	-64.4	-44.2	169.4	-72.9	169.7	-173	171.6	-1.3	111.4	E365 D366 H367 S372 A373	E365-R369 VanDerWaalsContact O-CG 3.32Å; E365-R369 WeakPolarHBondContact O-CG 3.34Å; E365-R369 PolarHBondContact O-N 3.47Å; D366-R369 WeakPolarHBondContact O-CB 3.29Å; D366-R369 PolarHBondContact O-N 3.49Å; D366-R369 IonicContact OD1-CZ 2.76Å; D366-R369 IonicContact OD1-NE 3.36Å; D366-R369 IonicContact OD1-NH1 2.65Å; D366-R369 PolarHBondContact OD1-NH1 3.48Å; H367-R369 PolarHBondContact O-N 3.36Å; R369-S372 WeakPolarHBondContact O-CB 3.44Å; R369-S372 PolarHBondContact O-N 3Å; R369-A373 PolarHBondContact O-N 3.47Å
370	L	73.7	Confident	68.7	Low	121 Å²	121	94.2 Å²	94.2	63%	0.634	45%	0.45	S	S	*	.	H	α-helix	trans	-62.1	-46.1	177.2	-174.9	65.5	0	0	0	111.6	D366 H367 S372 A373 R374	D366-L370 PolarHBondContact O-N 2.91Å; H367-L370 WeakPolarHBondContact O-CB 3.49Å; H367-L370 PolarHBondContact O-N 2.88Å; L370-S372 VanDerWaalsContact C-N 3.34Å; L370-S372 PolarHBondContact O-N 3.19Å; L370-A373 PolarHBondContact O-N 3.46Å; L370-R374 PolarHBondContact O-N 2.89Å
371	L	67.1	Low	67.8	Low	70 Å²	70	95 Å²	95	37%	0.366	45%	0.454	S	S	.	.	H	α-helix	trans	-59.6	-42.6	173	-73.3	172.3	0	0	0	112.1	H367 A373 R374 L375 L397	H367-L371 WeakPolarHBondContact O-CG 3.45Å; H367-L371 PolarHBondContact O-N 3.49Å; L371-A373 VanDerWaalsContact C-N 3.35Å; L371-A373 PolarHBondContact O-N 3.3Å; L371-R374 PolarHBondContact O-N 3.43Å; L371-L375 WeakPolarHBondContact O-CB 3.31Å; L371-L375 PolarHBondContact O-N 2.86Å; L371-L397 HydrophobicContact CB-CD2 4.41Å
372	S	68.8	Low	66.8	Low	52 Å²	52	96.2 Å²	96.2	36%	0.364	46%	0.459	S	S	.	.	H	α-helix	trans	-64.2	-37.2	176.9	-63.8	0	0	0	0	112.7	C368 R369 L370 K376	C368-S372 VanDerWaalsContact O-CB 3.29Å; C368-S372 WeakPolarHBondContact O-CB 3.34Å; C368-S372 PolarHBondContact O-N 3.34Å; C368-S372 PolarHBondContact O-OG 2.96Å; R369-S372 WeakPolarHBondContact O-CB 3.44Å; R369-S372 PolarHBondContact O-N 3Å; L370-S372 VanDerWaalsContact C-N 3.34Å; L370-S372 PolarHBondContact O-N 3.19Å; S372-K376 WeakPolarHBondContact O-CG 3.39Å; S372-K376 PolarHBondContact O-N 3.25Å
373	A	68.5	Low	65.4	Low	57 Å²	57	95.5 Å²	95.5	47%	0.471	47%	0.471	S	S	.	.	H	α-helix	trans	-67.3	-45.5	173.8	0	0	0	0	0	111.5	R369 L370 L371 L375 K376 Y377	R369-A373 PolarHBondContact O-N 3.47Å; L370-A373 PolarHBondContact O-N 3.46Å; L371-A373 VanDerWaalsContact C-N 3.35Å; L371-A373 PolarHBondContact O-N 3.3Å; A373-L375 VanDerWaalsContact C-N 3.32Å; A373-L375 PolarHBondContact O-N 2.92Å; A373-K376 WeakPolarHBondContact O-CB 3.49Å; A373-K376 PolarHBondContact O-N 2.98Å; A373-K376 VanDerWaalsContact O-N 3.14Å; A373-Y377 PolarHBondContact O-N 3.4Å
374	R	67.8	Low	64	Low	138 Å²	138	94.3 Å²	94.3	52%	0.521	48%	0.48	S	S	.	.	H	α-helix	trans	-61.6	-38.5	175.9	-163.6	170.2	-178.8	166.6	-1.1	111.8	L370 L371 Y377 M378	L370-R374 PolarHBondContact O-N 2.89Å; L371-R374 PolarHBondContact O-N 3.43Å; R374-Y377 PolarHBondContact O-N 3.23Å; R374-M378 WeakPolarHBondContact O-CG 3.44Å; R374-M378 PolarHBondContact O-N 2.97Å
375	L	63.7	Low	62.8	Low	27 Å²	27	94.4 Å²	94.4	14%	0.141	48%	0.483	C	S	.	.	H	α-helix	trans	-65.1	-38.5	172.3	-89.2	160.5	0	0	0	113.6	L371 A373 M378 K379 L393 L397	L371-L375 WeakPolarHBondContact O-CB 3.31Å; L371-L375 PolarHBondContact O-N 2.86Å; A373-L375 VanDerWaalsContact C-N 3.32Å; A373-L375 PolarHBondContact O-N 2.92Å; L375-M378 HydrophobicContact CD2-CE 4.31Å; L375-K379 WeakPolarHBondContact O-CG 3.5Å; L375-K379 PolarHBondContact O-N 3.41Å; L375-K379 VanDerWaalsContact O-N 3.09Å; L375-L393 HydrophobicContact CD1-CB 4.46Å; L375-L393 HydrophobicContact CD2-CB 4.4Å; L375-L393 HydrophobicContact CD2-CD1 4.33Å; L375-L397 HydrophobicContact CD1-CD1 3.3Å
376	K	69.1	Low	61.5	Low	161 Å²	161	98.6 Å²	98.6	70%	0.7	50%	0.503	S	S	*	.	H	α-helix	trans	-63	-43.3	172.1	-77.7	-179.4	177.8	-178.3	0	111.3	S372 A373 K379 S380	S372-K376 WeakPolarHBondContact O-CG 3.39Å; S372-K376 PolarHBondContact O-N 3.25Å; A373-K376 WeakPolarHBondContact O-CB 3.49Å; A373-K376 PolarHBondContact O-N 2.98Å; A373-K376 VanDerWaalsContact O-N 3.14Å; K376-K379 WeakPolarHBondContact O-CB 3.45Å; K376-K379 PolarHBondContact O-N 2.98Å; K376-S380 PolarHBondContact O-N 3.45Å; K376-S380 VanDerWaalsContact O-N 3.11Å; K376-S380 PolarHBondContact O-OG 3.03Å
377	Y	66.2	Low	60.1	Low	133 Å²	133	103.3 Å²	103.3	52%	0.522	52%	0.522	S	S	.	.	H	α-helix	trans	-64.5	-42.8	177.8	-176.6	-94.8	0	0	0	113	A373 R374 K379 S380 K381	A373-Y377 PolarHBondContact O-N 3.4Å; R374-Y377 PolarHBondContact O-N 3.23Å; Y377-K379 VanDerWaalsContact C-N 3.32Å; Y377-K379 PolarHBondContact O-N 3.37Å; Y377-S380 PolarHBondContact O-N 2.99Å; Y377-S380 PolarHBondContact O-OG 3.17Å; Y377-K381 HydrophobicContact CE1-CD 3.82Å; Y377-K381 PolarHBondContact O-N 3.05Å; Y377-K381 VanDerWaalsContact O-N 3.17Å; Y377-K381 VanDerWaalsContact OH-CE 3.24Å; Y377-K381 WeakPolarHBondContact OH-CE 3.47Å; Y377-K381 PolarHBondContact OH-NZ 3.44Å
378	M	59.4	Low	59	Low	87 Å²	87	106 Å²	106	43%	0.429	54%	0.535	S	S	.	.	H	α-helix	trans	-64.4	-36.6	174.8	-69.9	-160.6	-60.3	0	0	112.1	R374 L375 S380 K381 H382	R374-M378 WeakPolarHBondContact O-CG 3.44Å; R374-M378 PolarHBondContact O-N 2.97Å; L375-M378 HydrophobicContact CD2-CE 4.31Å; M378-S380 VanDerWaalsContact C-N 3.35Å; M378-S380 PolarHBondContact O-N 3.5Å; M378-K381 PolarHBondContact O-N 2.87Å; M378-H382 PolarHBondContact O-N 3Å
379	K	56.6	Low	58.1	Low	109 Å²	109	112.5 Å²	112.5	47%	0.474	56%	0.562	S	S	.	*	H	α-helix	trans	-63.5	-35.2	173.2	-81.3	-177.6	173.2	-170.8	0	113.8	L375 K376 Y377 I390	L375-K379 WeakPolarHBondContact O-CG 3.5Å; L375-K379 PolarHBondContact O-N 3.41Å; L375-K379 VanDerWaalsContact O-N 3.09Å; K376-K379 WeakPolarHBondContact O-CB 3.45Å; K376-K379 PolarHBondContact O-N 2.98Å; Y377-K379 VanDerWaalsContact C-N 3.32Å; Y377-K379 PolarHBondContact O-N 3.37Å; K379-I390 HydrophobicContact CG-CD1 4.19Å
380	S	61.1	Low	57.2	Low	92 Å²	92	107.5 Å²	107.5	64%	0.643	55%	0.547	S	S	*	.	H	α-helix	trans	-76.9	-24.5	177.8	54.3	0	0	0	0	113.4	K376 Y377 M378	K376-S380 PolarHBondContact O-N 3.45Å; K376-S380 VanDerWaalsContact O-N 3.11Å; K376-S380 PolarHBondContact O-OG 3.03Å; Y377-S380 PolarHBondContact O-N 2.99Å; Y377-S380 PolarHBondContact O-OG 3.17Å; M378-S380 VanDerWaalsContact C-N 3.35Å; M378-S380 PolarHBondContact O-N 3.5Å
381	K	52.6	Low	56.2	Low	135 Å²	135	105.1 Å²	105.1	59%	0.587	54%	0.54	S	S	*	.	H	α-helix	trans	-91.1	-23.5	176.9	-84.9	-167.8	165	-178.3	0	115.1	Y377 M378	Y377-K381 HydrophobicContact CE1-CD 3.82Å; Y377-K381 PolarHBondContact O-N 3.05Å; Y377-K381 VanDerWaalsContact O-N 3.17Å; Y377-K381 VanDerWaalsContact OH-CE 3.24Å; Y377-K381 WeakPolarHBondContact OH-CE 3.47Å; Y377-K381 PolarHBondContact OH-NZ 3.44Å; M378-K381 PolarHBondContact O-N 2.87Å
382	H	48.6	Very low	55.3	Low	116 Å²	116	110.4 Å²	110.4	54%	0.537	56%	0.556	S	S	.	*			trans	-121.2	77.7	-178.6	-63.5	-67	0	0	0	112.2	M378 S384	M378-H382 PolarHBondContact O-N 3Å; H382-S384 PolarHBondContact O-N 3.2Å
383	S	47.4	Very low	54.4	Low	122 Å²	122	111 Å²	111	85%	0.853	55%	0.554	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.4	-12.2	177.7	50.7	0	0	0	0	114.8
384	S	48.1	Very low	53.5	Low	106 Å²	106	114.6 Å²	114.6	74%	0.741	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	-123.2	-1.5	-167.2	58.6	0	0	0	0	116.7	H382	H382-S384 PolarHBondContact O-N 3.2Å
385	V	41.7	Very low	52.7	Low	86 Å²	86	111.1 Å²	111.1	52%	0.521	56%	0.556	S	S	.	*	S	Bend	trans	-115.1	101	-169.1	-173.2	0	0	0	0	113.7
386	Q	46	Very low	51.9	Low	120 Å²	120	112.3 Å²	112.3	56%	0.561	57%	0.567	S	S	*	*			trans	46.1	89.5	159.6	-65.2	-172	-18.1	0	0	117.9	H388 K389	Q386-H388 PolarHBondContact O-N 3.28Å; Q386-K389 PolarHBondContact O-N 3.03Å; Q386-K389 VanDerWaalsContact O-N 3.11Å
387	H	45.8	Very low	51	Low	170 Å²	170	105.6 Å²	105.6	79%	0.787	54%	0.538	S	S	*	.	H	α-helix	trans	-46	-30.8	168.6	-87.9	-94.5	0	0	0	115	K389 I390 S391	H387-K389 PolarHBondContact O-N 3.17Å; H387-I390 PolarHBondContact O-N 3.45Å; H387-S391 PolarHBondContact O-N 2.92Å
388	H	47.3	Very low	50.1	Low	162 Å²	162	104.5 Å²	104.5	75%	0.75	54%	0.541	S	S	*	.	H	α-helix	trans	-63.5	-35.7	-179.2	-58.4	-53.3	0	0	0	113.8	Q386 I390 S391	Q386-H388 PolarHBondContact O-N 3.28Å; H388-I390 VanDerWaalsContact C-N 3.28Å; H388-I390 PolarHBondContact O-N 3.41Å; H388-S391 WeakPolarHBondContact O-CB 3.25Å; H388-S391 PolarHBondContact O-N 3.41Å
389	K	48	Very low	49.5	Very low	142 Å²	142	107 Å²	107	62%	0.617	56%	0.555	S	S	*	*	H	α-helix	trans	-71.4	-22	178.4	-73.5	-172	178.1	-176.5	0	113.4	Q386 H387 W392	Q386-K389 PolarHBondContact O-N 3.03Å; Q386-K389 VanDerWaalsContact O-N 3.11Å; H387-K389 PolarHBondContact O-N 3.17Å; K389-W392 VanDerWaalsContact O-CD1 3.3Å
390	I	54.4	Low	48.6	Very low	51 Å²	51	106.7 Å²	106.7	26%	0.262	56%	0.558	S	S	.	*	H	α-helix	trans	-86.9	-25.4	177.6	-59	175.9	0	0	0	111	K379 H387 H388 K394	K379-I390 HydrophobicContact CG-CD1 4.19Å; H387-I390 PolarHBondContact O-N 3.45Å; H388-I390 VanDerWaalsContact C-N 3.28Å; H388-I390 PolarHBondContact O-N 3.41Å; I390-K394 PolarHBondContact O-N 3.16Å
391	S	51	Low	47.5	Very low	71 Å²	71	104.1 Å²	104.1	50%	0.497	54%	0.538	S	S	.	.	H	α-helix	trans	-60.3	-48.5	-178.3	-166.2	0	0	0	0	112.7	H387 H388 L393 K394 S395	H387-S391 PolarHBondContact O-N 2.92Å; H388-S391 WeakPolarHBondContact O-CB 3.25Å; H388-S391 PolarHBondContact O-N 3.41Å; S391-L393 PolarHBondContact O-N 3.35Å; S391-K394 WeakPolarHBondContact O-CB 3.27Å; S391-K394 PolarHBondContact O-N 3.02Å; S391-S395 PolarHBondContact O-N 3.22Å; S391-S395 PolarHBondContact O-OG 3.11Å
392	W	49.1	Very low	46.7	Very low	182 Å²	182	102.4 Å²	102.4	69%	0.689	54%	0.541	S	S	*	.	H	α-helix	trans	-65.1	-44.3	-175.9	95.3	-54.9	0	0	0	112.4	K389 K394 S395 S396	K389-W392 VanDerWaalsContact O-CD1 3.3Å; W392-K394 VanDerWaalsContact C-N 3.25Å; W392-K394 PolarHBondContact O-N 3.43Å; W392-S395 WeakPolarHBondContact O-CB 3.36Å; W392-S395 PolarHBondContact O-N 3.5Å; W392-S396 PolarHBondContact O-N 3.43Å; W392-S396 PolarHBondContact O-OG 3.4Å; W392-S396 VanDerWaalsContact O-OG 3.12Å
393	L	50.6	Low	46.1	Very low	64 Å²	64	103.5 Å²	103.5	34%	0.335	55%	0.55	S	S	.	*	H	α-helix	trans	-57.8	-38	175	-91.3	154.8	0	0	0	112.1	L375 S391 L397	L375-L393 HydrophobicContact CD1-CB 4.46Å; L375-L393 HydrophobicContact CD2-CB 4.4Å; L375-L393 HydrophobicContact CD2-CD1 4.33Å; S391-L393 PolarHBondContact O-N 3.35Å; L393-L397 WeakPolarHBondContact O-CB 3.48Å; L393-L397 PolarHBondContact O-N 2.93Å
394	K	48.6	Very low	45.4	Very low	132 Å²	132	104.1 Å²	104.1	57%	0.574	54%	0.538	S	S	*	.	H	α-helix	trans	-70.8	-34.9	177.2	-156.7	-174	-178.7	-160.6	0	112	I390 S391 W392 N398	I390-K394 PolarHBondContact O-N 3.16Å; S391-K394 WeakPolarHBondContact O-CB 3.27Å; S391-K394 PolarHBondContact O-N 3.02Å; W392-K394 VanDerWaalsContact C-N 3.25Å; W392-K394 PolarHBondContact O-N 3.43Å; K394-N398 PolarHBondContact O-N 3.5Å
395	S	50.7	Low	44.6	Very low	66 Å²	66	108.6 Å²	108.6	46%	0.462	54%	0.544	S	S	.	.	H	α-helix	trans	-69.3	-45.6	173.2	-59.1	0	0	0	0	111.8	S391 W392 L397 N398 I399	S391-S395 PolarHBondContact O-N 3.22Å; S391-S395 PolarHBondContact O-OG 3.11Å; W392-S395 WeakPolarHBondContact O-CB 3.36Å; W392-S395 PolarHBondContact O-N 3.5Å; S395-L397 PolarHBondContact O-N 3.39Å; S395-N398 PolarHBondContact O-N 3.27Å; S395-I399 WeakPolarHBondContact O-CG1 3.35Å; S395-I399 PolarHBondContact O-N 3.33Å
396	S	47.7	Very low	44	Very low	51 Å²	51	111.1 Å²	111.1	36%	0.357	55%	0.553	S	S	.	*	H	α-helix	trans	-61.7	-41.1	177.3	-54.8	0	0	0	0	112.6	W392 N398 I399 L400	W392-S396 PolarHBondContact O-N 3.43Å; W392-S396 PolarHBondContact O-OG 3.4Å; W392-S396 VanDerWaalsContact O-OG 3.12Å; S396-N398 VanDerWaalsContact C-N 3.35Å; S396-N398 PolarHBondContact O-N 3.38Å; S396-I399 PolarHBondContact O-N 2.87Å; S396-L400 PolarHBondContact O-N 2.97Å; S396-L400 VanDerWaalsContact O-N 3.13Å
397	L	49.8	Very low	43.2	Very low	21 Å²	21	114.4 Å²	114.4	11%	0.11	57%	0.566	C	S	.	*	H	α-helix	trans	-66	-33.5	175.3	-86.5	160.2	0	0	0	113.3	C368 L371 L375 L393 S395 I399 L400 V401	C368-L397 HydrophobicContact CB-CD2 4.06Å; L371-L397 HydrophobicContact CB-CD2 4.41Å; L375-L397 HydrophobicContact CD1-CD1 3.3Å; L393-L397 WeakPolarHBondContact O-CB 3.48Å; L393-L397 PolarHBondContact O-N 2.93Å; S395-L397 PolarHBondContact O-N 3.39Å; L397-I399 VanDerWaalsContact C-N 3.28Å; L397-I399 PolarHBondContact O-N 2.87Å; L397-L400 PolarHBondContact O-N 3.28Å; L397-V401 PolarHBondContact O-N 3.48Å
398	N	47.8	Very low	42.3	Very low	109 Å²	109	116.4 Å²	116.4	58%	0.583	57%	0.568	S	S	*	*	H	α-helix	trans	-70.9	-22.7	174.9	-80	-1.2	0	0	0	113.2	K394 S395 S396	K394-N398 PolarHBondContact O-N 3.5Å; S395-N398 PolarHBondContact O-N 3.27Å; S396-N398 VanDerWaalsContact C-N 3.35Å; S396-N398 PolarHBondContact O-N 3.38Å
399	I	46.2	Very low	41.3	Very low	140 Å²	140	116.2 Å²	116.2	72%	0.718	57%	0.567	S	S	*	*	H	α-helix	trans	-80.7	-39.3	174.8	-65.3	163.9	0	0	0	110.4	S395 S396 L397	S395-I399 WeakPolarHBondContact O-CG1 3.35Å; S395-I399 PolarHBondContact O-N 3.33Å; S396-I399 PolarHBondContact O-N 2.87Å; L397-I399 VanDerWaalsContact C-N 3.28Å; L397-I399 PolarHBondContact O-N 2.87Å
400	L	37.3	Very low	40.3	Very low	102 Å²	102	114.3 Å²	114.3	53%	0.534	57%	0.572	S	S	.	*	H	α-helix	trans	-83.2	-17.9	-176.4	-70.1	167.4	0	0	0	114.5	S396 L397	S396-L400 PolarHBondContact O-N 2.97Å; S396-L400 VanDerWaalsContact O-N 3.13Å; L397-L400 PolarHBondContact O-N 3.28Å
401	V	38.7	Very low	39	Very low	38 Å²	38	124 Å²	124	23%	0.23	61%	0.605	C	S	.	*			trans	-122.3	101.2	178	-173.4	0	0	0	0	111	C368 L397 L403	C368-V401 HydrophobicContact CB-CG2 3.35Å; C368-V401 VanDerWaalsContact SG-CG2 3.51Å; L397-V401 PolarHBondContact O-N 3.48Å; V401-L403 PolarHBondContact O-N 2.96Å
402	P	35.3	Very low	37.9	Very low	100 Å²	100	131.1 Å²	131.1	65%	0.649	62%	0.621	S	S	*	*			trans	-61.4	109.9	163.3	-18	31.2	0	0	0	108.9	K404	P402-K404 PolarHBondContact O-N 3.45Å
403	L	36.2	Very low	36.8	Very low	139 Å²	139	132.5 Å²	132.5	73%	0.728	63%	0.632	S	S	*	*			trans	-61.4	96.3	178.6	-79.7	165	0	0	0	110.5	V401 K405	V401-L403 PolarHBondContact O-N 2.96Å; L403-K405 PolarHBondContact O-N 3.5Å
404	K	33.9	Very low	35.7	Very low	135 Å²	135	138 Å²	138	59%	0.587	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.2	112	179.8	-81.5	174	171.8	164.9	0	111.3	E365 P402	E365-K404 WeakPolarHBondContact OE1-CE 3.29Å; E365-K404 IonicContact OE1-NZ 2.86Å; E365-K404 PolarHBondContact OE1-NZ 2.95Å; E365-K404 IonicContact OE2-NZ 2.66Å; E365-K404 PolarHBondContact OE2-NZ 3.32Å; P402-K404 PolarHBondContact O-N 3.45Å
405	K	31.3	Very low	34.8	Very low	200 Å²	200	141.2 Å²	141.2	87%	0.87	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	52.9	66	155.4	-60.2	-178.5	178.9	177	0	116.9	L403 K407	L403-K405 PolarHBondContact O-N 3.5Å; K405-K407 PolarHBondContact O-N 3.45Å
406	L	29.1	Very low	33.8	Very low	138 Å²	138	145.4 Å²	145.4	72%	0.723	68%	0.684	S	S	*	*			trans	-74.8	101.2	153.1	-86.9	167.9	0	0	0	109.9	Y408	L406-Y408 HydrophobicContact CB-CD2 4.32Å; L406-Y408 HydrophobicContact CB-CE2 4.42Å; L406-Y408 PolarHBondContact O-N 2.94Å
407	K	27.4	Very low	33	Very low	190 Å²	190	149.4 Å²	149.4	83%	0.826	70%	0.701	S	S	*	*			trans	-63.6	97	168.4	-75.6	-176.6	175.2	-177.6	0	109.8	K405 H409	K405-K407 PolarHBondContact O-N 3.45Å; K407-H409 PolarHBondContact O-N 2.97Å
408	Y	28.2	Very low	32.4	Very low	211 Å²	211	158 Å²	158	83%	0.827	73%	0.734	S	S	*	*			trans	-82	92	169.6	-99.3	-84	0	0	0	110.9	L406	L406-Y408 HydrophobicContact CB-CD2 4.32Å; L406-Y408 HydrophobicContact CB-CE2 4.42Å; L406-Y408 PolarHBondContact O-N 2.94Å
409	H	26.5	Very low	31.8	Very low	159 Å²	159	162 Å²	162	74%	0.736	74%	0.741	S	S	*	*			trans	-77.1	140.6	159.2	-85.9	-44.7	0	0	0	110.6	K407	K407-H409 PolarHBondContact O-N 2.97Å
410	S	26.3	Very low	31.3	Very low	102 Å²	102	159.9 Å²	159.9	71%	0.713	73%	0.734	S	S	*	*	S	Bend	trans	67.3	109	148.1	-55.8	0	0	0	0	119.5	R412	S410-R412 PolarHBondContact O-N 2.78Å
411	R	26.5	Very low	31.2	Very low	254 Å²	254	163.1 Å²	163.1	96%	0.958	74%	0.744	S	S	*	*			trans	30.3	88.5	138.1	-67.6	-179.9	171.7	-179.8	-2.1	116.5
412	R	28.6	Very low	31.1	Very low	221 Å²	221	170.2 Å²	170.2	83%	0.834	77%	0.767	S	S	*	*			trans	-126.9	108.8	150.4	-77.2	-169.6	176.6	-176.7	-0.4	110.6	S410 F414	S410-R412 PolarHBondContact O-N 2.78Å; R412-F414 PolarHBondContact O-N 2.68Å
413	K	26.1	Very low	31.2	Very low	211 Å²	211	171 Å²	171	92%	0.917	76%	0.762	S	S	*	*			trans	-65.9	99.8	166.9	-72.5	-177.6	176	-178.7	0	108.4	K415	K413-K415 PolarHBondContact O-N 3.39Å
414	F	27.3	Very low	31.2	Very low	180 Å²	180	170.8 Å²	170.8	79%	0.789	76%	0.76	S	S	*	*			trans	-75.7	101.4	164	-91.7	-86.4	0	0	0	108.8	R412 L416	R412-F414 PolarHBondContact O-N 2.68Å; F414-L416 PolarHBondContact O-N 3Å; F414-L416 VanDerWaalsContact O-N 3.11Å
415	K	29.6	Very low	31.2	Very low	198 Å²	198	171.1 Å²	171.1	86%	0.861	76%	0.764	S	S	*	*			trans	-63.5	108	163	-80.2	-176.3	173.2	-178.4	0	107.6	K413 N417	K413-K415 PolarHBondContact O-N 3.39Å; K415-N417 PolarHBondContact O-N 3.47Å
416	L	29.9	Very low	31.5	Very low	154 Å²	154	167.7 Å²	167.7	81%	0.806	75%	0.75	S	S	*	*			trans	-61.7	121.4	168.4	-106.6	139.8	0	0	0	108.6	F414 Y418	F414-L416 PolarHBondContact O-N 3Å; F414-L416 VanDerWaalsContact O-N 3.11Å; L416-Y418 WeakPolarHBondContact O-CD2 3.41Å; L416-Y418 PolarHBondContact O-N 3.35Å
417	N	31.9	Very low	31.8	Very low	136 Å²	136	168 Å²	168	73%	0.727	75%	0.753	S	S	*	*			trans	-81.5	109.8	-174.2	-155.4	-3.1	0	0	0	109.1	K415 R419	K415-N417 PolarHBondContact O-N 3.47Å; N417-R419 PolarHBondContact O-N 3.31Å
418	Y	35.4	Very low	32	Very low	201 Å²	201	168 Å²	168	79%	0.788	75%	0.754	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.9	2.9	-165.8	-95.9	-94.1	0	0	0	116.2	L416	L416-Y418 WeakPolarHBondContact O-CD2 3.41Å; L416-Y418 PolarHBondContact O-N 3.35Å
419	R	36.9	Very low	32.4	Very low	193 Å²	193	164.2 Å²	164.2	73%	0.728	75%	0.748	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.3	-45.7	-174.1	-89.8	-175.3	169	174.6	-4.2	114.7	N417 K421 R422	N417-R419 PolarHBondContact O-N 3.31Å; R419-K421 PolarHBondContact O-N 3.46Å; R419-R422 PolarHBondContact O-N 2.98Å; R419-R422 VanDerWaalsContact O-N 3.15Å
420	T	35.6	Very low	32.7	Very low	96 Å²	96	164.8 Å²	164.8	59%	0.589	75%	0.75	S	S	*	*	H	α-helix	trans	-70.4	-5.5	-170.8	-36	0	0	0	0	114.3
421	K	34.5	Very low	33	Very low	169 Å²	169	168 Å²	168	74%	0.735	76%	0.758	S	S	*	*	H	α-helix	trans	-94.1	-6.7	176.3	-142.9	-179.8	-177.2	-174.3	0	114.1	R419	R419-K421 PolarHBondContact O-N 3.46Å
422	R	37.2	Very low	33.2	Very low	187 Å²	187	161.2 Å²	161.2	71%	0.706	75%	0.75	S	S	*	*	H	α-helix	trans	-95.1	-38	170.9	-76.8	-172.9	-160.6	177.5	4.4	113	R419 I424 Q425 Q426	R419-R422 PolarHBondContact O-N 2.98Å; R419-R422 VanDerWaalsContact O-N 3.15Å; R422-I424 VanDerWaalsContact C-N 3.28Å; R422-I424 PolarHBondContact O-N 3.23Å; R422-Q425 PolarHBondContact O-N 3.47Å; R422-Q426 PolarHBondContact O-N 2.86Å
423	E	36.8	Very low	33.4	Very low	118 Å²	118	158.2 Å²	158.2	55%	0.551	75%	0.751	S	S	*	*	H	α-helix	trans	-65.3	-28.3	-176.2	-70.1	158.7	176.9	0	0	112.9	Q425	E423-Q425 VanDerWaalsContact C-N 3.35Å
424	I	35.5	Very low	33.6	Very low	133 Å²	133	153.4 Å²	153.4	68%	0.682	74%	0.742	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.4	-5.9	176	-59.6	173.9	0	0	0	112.2	R422	R422-I424 VanDerWaalsContact C-N 3.28Å; R422-I424 PolarHBondContact O-N 3.23Å
425	Q	35.3	Very low	33.8	Very low	143 Å²	143	151.6 Å²	151.6	67%	0.668	74%	0.74	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.2	7.5	-175.6	-151.4	161.6	7.5	0	0	113.2	R422 E423	R422-Q425 PolarHBondContact O-N 3.47Å; E423-Q425 VanDerWaalsContact C-N 3.35Å
426	Q	36.3	Very low	34	Very low	127 Å²	127	150.8 Å²	150.8	59%	0.593	74%	0.74	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.1	-22.9	174.2	-69.3	-176.1	-67.1	0	0	113.4	R422 F428	R422-Q426 PolarHBondContact O-N 2.86Å; Q426-F428 VanDerWaalsContact C-N 3.26Å; Q426-F428 PolarHBondContact O-N 3.39Å
427	D	35.4	Very low	34.1	Very low	145 Å²	145	149.3 Å²	149.3	78%	0.775	74%	0.741	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.6	8.6	-177.6	-74.4	-5.9	0	0	0	115.6
428	F	32.6	Very low	34.2	Very low	191 Å²	191	150.7 Å²	150.7	84%	0.838	74%	0.743	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.2	-0.4	175.4	-93.9	-82.9	0	0	0	114.7	Q426	Q426-F428 VanDerWaalsContact C-N 3.26Å; Q426-F428 PolarHBondContact O-N 3.39Å
429	N	35.7	Very low	34	Very low	131 Å²	131	147.4 Å²	147.4	70%	0.701	74%	0.739	S	S	*	*	S	Bend	trans	-115	12.6	-174.6	-76.2	-8.5	0	0	0	114.7
430	H	33.4	Very low	33.9	Very low	171 Å²	171	144.4 Å²	144.4	79%	0.792	74%	0.742	S	S	*	*			trans	-139	83	174.3	-79.5	-66.5	0	0	0	112.2
431	L	33	Very low	33.9	Very low	169 Å²	169	148.5 Å²	148.5	89%	0.885	75%	0.754	S	S	*	*	S	Bend	trans	-158.5	101.3	152.4	-136.2	82.4	0	0	0	111.2
432	S	30.7	Very low	33.5	Very low	112 Å²	112	143.6 Å²	143.6	78%	0.783	75%	0.752	S	S	*	*			trans	61.1	125.1	175.7	-54.1	0	0	0	0	117.3
433	D	32.7	Very low	33.4	Very low	158 Å²	158	140.2 Å²	140.2	85%	0.845	75%	0.754	S	S	*	*			cis	51.6	71.9	5.4	-80.7	2.1	0	0	0	116.1
434	C	29.5	Very low	33.4	Very low	109 Å²	109	145.7 Å²	145.7	74%	0.736	77%	0.77	S	S	*	*				174.3	108.2	122.8	-92.7	0	0	0	0	113.2
435	N	32.1	Very low	33.2	Very low	142 Å²	142	148.7 Å²	148.7	76%	0.759	78%	0.778	S	S	*	*			trans	66.8	135.2	130.9	-62.5	-20.3	0	0	0	123.4
436	Q	34	Very low	33.1	Very low	182 Å²	182	149.9 Å²	149.9	85%	0.85	79%	0.789	S	S	*	*			trans	90.9	138.6	149.8	-72.5	168.7	5	0	0	121.2
437	C	32.1	Very low	32.8	Very low	122 Å²	122	150.5 Å²	150.5	82%	0.824	80%	0.796	S	S	*	*			trans	85.4	73.2	-178	-56.5	0	0	0	0	114.9
438	Q	33.4	Very low	32.8	Very low	166 Å²	166	149.8 Å²	149.8	78%	0.776	79%	0.792	S	S	*	*				55	110.9	80.4	-78.9	-166.4	-85.8	0	0	115.8
439	D	31	Very low	32.8	Very low	131 Å²	131	148.3 Å²	148.3	70%	0.701	79%	0.788	S	S	*	*			trans	71.3	139.4	138.9	-42.8	-27.7	0	0	0	116.7
440	V	35.4	Very low	32.3	Very low	130 Å²	130	148.7 Å²	148.7	79%	0.788	79%	0.789	S	S	*	*			cis	-142.8	154.9	28.9	170.9	0	0	0	0	112.1
441	E	34.8	Very low	32.3	Very low	183 Å²	183	148.2 Å²	148.2	86%	0.855	79%	0.789	S	S	*	*			trans	-31.9	148.6	172	-52.8	171.3	130.1	0	0	119.6
442	G	25.6	Very low	32.1	Very low	66 Å²	66	145.4 Å²	145.4	68%	0.68	78%	0.779	S	S	*	*			trans	-89.7	-147.8	151.1	0	0	0	0	0	110.8
443	P	36.1	Very low	32	Very low	116 Å²	116	146.8 Å²	146.8	75%	0.753	78%	0.777	S	S	*	*			cis	-140.6	-160.9	-2.8	32.9	-8.2	0	0	0	113.7
444	R	35.9	Very low	31.9	Very low	233 Å²	233	144.9 Å²	144.9	88%	0.879	77%	0.767	S	S	*	*			trans	102.5	103.5	156	-55.6	-175.8	-177.6	-165.4	0.8	119
445	K	31.1	Very low	32.3	Very low	195 Å²	195	146.9 Å²	146.9	85%	0.848	77%	0.765	S	S	*	*			trans	20.6	129.1	134.5	-59.5	-176.5	176.6	-172.3	0	119.3
446	N	34.7	Very low	32.5	Very low	169 Å²	169	146 Å²	146	90%	0.904	76%	0.761	S	S	*	*				-147.4	143.5	128.7	-110.8	-14.4	0	0	0	110.6
447	D	30.6	Very low	32.7	Very low	139 Å²	139	143.6 Å²	143.6	74%	0.743	75%	0.753	S	S	*	*			trans	-83.7	177.5	177.5	-68.6	-64.8	0	0	0	112.1
448	N	33.4	Very low	32.8	Very low	130 Å²	130	143.7 Å²	143.7	70%	0.695	75%	0.746	S	S	*	*			trans	101.9	102.5	158.8	-62.3	-44.4	0	0	0	119.5
449	Q	33	Very low	33	Very low	161 Å²	161	142.4 Å²	142.4	75%	0.752	74%	0.744	S	S	*	*				67.9	118.8	113.9	-69.1	-179.5	61.3	0	0	120.3
450	L	26.3	Very low	33.1	Very low	139 Å²	139	144.4 Å²	144.4	73%	0.728	75%	0.75	S	S	*	*				72.2	118.4	126.4	-146.1	84.9	0	0	0	117.7
451	M	31.9	Very low	33.1	Very low	161 Å²	161	144 Å²	144	79%	0.793	75%	0.752	S	S	*	*				169.1	145.4	111.8	-91.9	-59.7	-156.5	0	0	113.1
452	T	29.5	Very low	32.9	Very low	110 Å²	110	142.6 Å²	142.6	68%	0.675	75%	0.751	S	S	*	*			trans	-72.6	151.1	175.5	39.5	0	0	0	0	115.6
453	L	29.6	Very low	33.2	Very low	140 Å²	140	144.2 Å²	144.2	73%	0.733	76%	0.758	S	S	*	*			trans	81.5	121.8	139.7	-69.9	161.1	0	0	0	121.4
454	N	30.6	Very low	33.1	Very low	119 Å²	119	144.9 Å²	144.9	64%	0.636	76%	0.76	S	S	*	*			trans	92.2	137.2	130.3	-70.4	-1.7	0	0	0	122.3
455	H	37.5	Very low	32.7	Very low	151 Å²	151	139 Å²	139	70%	0.699	75%	0.754	S	S	*	*			trans	63.8	146.8	158.6	-58.5	-57.1	0	0	0	117.9
456	D	36.4	Very low	32.7	Very low	123 Å²	123	135.2 Å²	135.2	66%	0.658	75%	0.752	S	S	*	*			cis	-158.5	158	-20.4	-99.6	-16.8	0	0	0	107.9
457	D	36.9	Very low	32.7	Very low	131 Å²	131	136.9 Å²	136.9	70%	0.701	76%	0.755	S	S	*	*			trans	59.9	140.6	144.1	-73.2	-2.2	0	0	0	125.7
458	N	35.3	Very low	32.8	Very low	125 Å²	125	137.3 Å²	137.3	67%	0.668	76%	0.756	S	S	*	*			trans	70.6	92.8	144.2	-63	-23.9	0	0	0	120.9
459	N	36.9	Very low	32.7	Very low	138 Å²	138	138 Å²	138	74%	0.738	76%	0.758	S	S	*	*				171	110.7	95.2	-81	-36.5	0	0	0	109.8
460	Q	34.3	Very low	32.5	Very low	174 Å²	174	139.1 Å²	139.1	81%	0.813	77%	0.766	S	S	*	*				77.2	93.3	78.6	-162.8	179.5	43.5	0	0	114.3
461	S	35.2	Very low	32.8	Very low	121 Å²	121	142.8 Å²	142.8	85%	0.846	78%	0.776	S	S	*	*			trans	-165.4	133.5	139.5	50.4	0	0	0	0	110.8
462	D	29.9	Very low	32.7	Very low	154 Å²	154	143.4 Å²	143.4	82%	0.824	78%	0.777	S	S	*	*			trans	-84.7	150.3	-165.7	-59.2	-83.5	0	0	0	115.6
463	A	31.9	Very low	32.8	Very low	100 Å²	100	145.7 Å²	145.7	83%	0.826	79%	0.785	S	S	*	*			trans	-158.3	78.7	153.9	0	0	0	0	0	112.3
464	T	35.2	Very low	32.9	Very low	130 Å²	130	147.4 Å²	147.4	80%	0.798	79%	0.794	S	S	*	*			trans	-20.8	124.9	164.5	51.1	0	0	0	0	118.5
465	S	27.6	Very low	33.1	Very low	108 Å²	108	149 Å²	149	76%	0.755	80%	0.803	S	S	*	*				165	121.5	113.2	-74.3	0	0	0	0	115.5
466	S	30	Very low	33.1	Very low	116 Å²	116	147.6 Å²	147.6	81%	0.811	80%	0.8	S	S	*	*			trans	70.4	62.1	140.8	-53.7	0	0	0	0	121.4
467	E	34.4	Very low	33.3	Very low	204 Å²	204	147.8 Å²	147.8	95%	0.953	80%	0.797	S	S	*	*			trans	-124.3	78.8	152.3	-149.5	164.4	-138.5	0	0	111.1
468	L	33.3	Very low	33.5	Very low	149 Å²	149	146.1 Å²	146.1	78%	0.78	79%	0.793	S	S	*	*			trans	-92.6	136.1	-177.3	-98.4	165.7	0	0	0	112
469	I	30.6	Very low	33.8	Very low	144 Å²	144	147.1 Å²	147.1	74%	0.738	79%	0.792	S	S	*	*			trans	70.6	93.7	153.9	-51.4	155.6	0	0	0	116.5
470	M	30	Very low	34	Very low	185 Å²	185	146 Å²	146	91%	0.911	79%	0.785	S	S	*	*				-164.2	55.9	124.6	-88.7	-126	-74.5	0	0	111.6
471	K	30.9	Very low	34.5	Very low	215 Å²	215	143.7 Å²	143.7	94%	0.935	77%	0.772	S	S	*	*			trans	-91.9	84.9	159.6	-91.8	-171.7	175.8	178.6	0	109.5
472	Q	30.8	Very low	34.8	Very low	175 Å²	175	144 Å²	144	82%	0.818	76%	0.764	S	S	*	*			trans	-155.5	148.4	161.7	-104.3	167.5	10.3	0	0	108
473	N	30.5	Very low	35.5	Very low	157 Å²	157	141.8 Å²	141.8	84%	0.84	75%	0.751	S	S	*	*			trans	86.4	20.5	176	-51.5	-23.6	0	0	0	119.9
474	L	32.6	Very low	36.1	Very low	176 Å²	176	141.4 Å²	141.4	92%	0.921	74%	0.735	S	S	*	*			trans	-102.6	87.2	159	-77.5	170.6	0	0	0	110.3
475	N	35.7	Very low	36.7	Very low	154 Å²	154	140.4 Å²	140.4	82%	0.824	73%	0.725	S	S	*	*			trans	-152.2	31	176.4	-122.2	-3.3	0	0	0	114.6
476	N	37.2	Very low	37.2	Very low	121 Å²	121	143.4 Å²	143.4	65%	0.647	72%	0.721	S	S	*	*			trans	-106.7	8.4	179.1	-90.2	-34.1	0	0	0	114.5	K479	N476-K479 PolarHBondContact O-N 2.91Å
477	E	39.6	Very low	38	Very low	126 Å²	126	143.6 Å²	143.6	59%	0.589	71%	0.707	S	S	*	*	H	α-helix	trans	-58.9	-30.6	-177.2	-106.8	-162.9	98.5	0	0	117.1	K479 L480 K481	E477-K479 VanDerWaalsContact C-N 3.31Å; E477-K479 PolarHBondContact O-N 3.46Å; E477-L480 PolarHBondContact O-N 3.24Å; E477-K481 PolarHBondContact O-N 3.29Å; E477-K481 IonicContact OE1-NZ 3.46Å; E477-K481 PolarHBondContact OE1-NZ 3.33Å
478	P	42.5	Very low	39	Very low	96 Å²	96	137.4 Å²	137.4	62%	0.623	68%	0.683	S	S	*	*	H	α-helix	trans	-61.8	-37.3	-179.6	-24.9	34.5	0	0	0	113.2	K481 L482	P478-K481 PolarHBondContact O-N 3.43Å; P478-L482 WeakPolarHBondContact O-CB 3.49Å; P478-L482 PolarHBondContact O-N 3.48Å
479	K	41.2	Very low	39.9	Very low	147 Å²	147	134 Å²	134	64%	0.639	67%	0.672	S	S	*	*	H	α-helix	trans	-70.8	-36.6	-174.6	-70.2	-177.6	176.3	175.2	0	112.3	N476 E477 L482 I483	N476-K479 PolarHBondContact O-N 2.91Å; E477-K479 VanDerWaalsContact C-N 3.31Å; E477-K479 PolarHBondContact O-N 3.46Å; K479-L482 PolarHBondContact O-N 3.01Å; K479-I483 WeakPolarHBondContact O-CB 3.38Å; K479-I483 WeakPolarHBondContact O-CD1 3.37Å; K479-I483 VanDerWaalsContact O-CG1 3.23Å; K479-I483 WeakPolarHBondContact O-CG1 3.44Å; K479-I483 PolarHBondContact O-N 2.95Å
480	L	39.7	Very low	41	Very low	114 Å²	114	130.4 Å²	130.4	60%	0.597	65%	0.654	S	S	*	*	H	α-helix	trans	-68.1	-40.6	176.2	-84.7	158.9	0	0	0	112.3	E477 N484	E477-L480 PolarHBondContact O-N 3.24Å; L480-N484 WeakPolarHBondContact O-CB 3.46Å; L480-N484 PolarHBondContact O-N 3.48Å
481	K	44.9	Very low	42.3	Very low	125 Å²	125	125.6 Å²	125.6	54%	0.543	63%	0.631	S	S	.	*	H	α-helix	trans	-65.1	-41.2	173.2	-80.9	168.5	173	144.9	0	111.7	E477 P478 N484 N485	E477-K481 PolarHBondContact O-N 3.29Å; E477-K481 IonicContact OE1-NZ 3.46Å; E477-K481 PolarHBondContact OE1-NZ 3.33Å; P478-K481 PolarHBondContact O-N 3.43Å; K481-N484 PolarHBondContact O-N 3.5Å; K481-N485 WeakPolarHBondContact O-CB 3.37Å; K481-N485 PolarHBondContact O-N 2.77Å
482	L	41.5	Very low	43.8	Very low	129 Å²	129	123 Å²	123	68%	0.675	62%	0.62	S	S	*	*	H	α-helix	trans	-64.7	-44.2	176.9	-149.3	79.4	0	0	0	112.2	P478 K479 N485 Y486	P478-L482 WeakPolarHBondContact O-CB 3.49Å; P478-L482 PolarHBondContact O-N 3.48Å; K479-L482 PolarHBondContact O-N 3.01Å; L482-N485 PolarHBondContact O-N 3.24Å; L482-Y486 WeakPolarHBondContact O-CB 3.43Å; L482-Y486 PolarHBondContact O-N 2.97Å
483	I	45.1	Very low	45	Very low	106 Å²	106	117.8 Å²	117.8	54%	0.544	60%	0.602	S	S	.	*	H	α-helix	trans	-62.3	-45.1	176.6	-70.5	165.2	0	0	0	111	K479 Y486 K487	K479-I483 WeakPolarHBondContact O-CB 3.38Å; K479-I483 WeakPolarHBondContact O-CD1 3.37Å; K479-I483 VanDerWaalsContact O-CG1 3.23Å; K479-I483 WeakPolarHBondContact O-CG1 3.44Å; K479-I483 PolarHBondContact O-N 2.95Å; I483-Y486 PolarHBondContact O-N 3.22Å; I483-K487 WeakPolarHBondContact O-CB 3.45Å; I483-K487 PolarHBondContact O-N 3.12Å
484	N	44.5	Very low	46.2	Very low	93 Å²	93	117.9 Å²	117.9	50%	0.497	59%	0.591	S	S	.	*	H	α-helix	trans	-67	-38.1	177.9	-84.2	-16.6	0	0	0	113	L480 K481 K487 T488	L480-N484 WeakPolarHBondContact O-CB 3.46Å; L480-N484 PolarHBondContact O-N 3.48Å; K481-N484 PolarHBondContact O-N 3.5Å; N484-K487 PolarHBondContact O-N 2.95Å; N484-T488 PolarHBondContact O-N 3.23Å; N484-T488 PolarHBondContact O-OG1 3.46Å
485	N	48.5	Very low	47.8	Very low	108 Å²	108	116 Å²	116	58%	0.578	58%	0.575	S	S	*	*	H	α-helix	trans	-66.1	-42.4	174.7	-76.1	-5.3	0	0	0	111.7	K481 L482 T488 S489	K481-N485 WeakPolarHBondContact O-CB 3.37Å; K481-N485 PolarHBondContact O-N 2.77Å; L482-N485 PolarHBondContact O-N 3.24Å; N485-T488 WeakPolarHBondContact CA-OG1 3.4Å; N485-T488 PolarHBondContact O-N 3.11Å; N485-T488 PolarHBondContact O-OG1 2.96Å; N485-T488 VanDerWaalsContact O-OG1 3.11Å; N485-S489 VanDerWaalsContact O-CB 3.27Å; N485-S489 WeakPolarHBondContact O-CB 3.46Å; N485-S489 PolarHBondContact O-N 3.46Å
486	Y	38.5	Very low	49	Very low	172 Å²	172	117.3 Å²	117.3	68%	0.675	57%	0.569	S	S	*	*	H	α-helix	trans	-64.6	-42.1	175.5	-150.6	-92.4	0	0	0	111.3	L482 I483 S489 L490	L482-Y486 WeakPolarHBondContact O-CB 3.43Å; L482-Y486 PolarHBondContact O-N 2.97Å; I483-Y486 PolarHBondContact O-N 3.22Å; Y486-S489 PolarHBondContact O-N 3.37Å; Y486-L490 VanDerWaalsContact O-CB 3.27Å; Y486-L490 WeakPolarHBondContact O-CB 3.47Å; Y486-L490 PolarHBondContact O-N 2.89Å
487	K	45.3	Very low	50	Low	119 Å²	119	113.7 Å²	113.7	52%	0.517	56%	0.556	S	S	.	*	H	α-helix	trans	-61.8	-45.9	177	-163.7	174.4	-172.8	-179.7	0	111.7	I483 N484 I491	I483-K487 WeakPolarHBondContact O-CB 3.45Å; I483-K487 PolarHBondContact O-N 3.12Å; N484-K487 PolarHBondContact O-N 2.95Å; K487-I491 HydrophobicContact CG-CD1 4.07Å; K487-I491 WeakPolarHBondContact O-CB 3.45Å; K487-I491 WeakPolarHBondContact O-CD1 3.46Å; K487-I491 WeakPolarHBondContact O-CG1 3.39Å; K487-I491 PolarHBondContact O-N 2.92Å
488	T	56.4	Low	50.9	Low	75 Å²	75	111.2 Å²	111.2	46%	0.46	55%	0.546	S	S	.	.	H	α-helix	trans	-70	-37.1	176.9	46.5	0	0	0	0	113.1	N484 N485 K492	N484-T488 PolarHBondContact O-N 3.23Å; N484-T488 PolarHBondContact O-OG1 3.46Å; N485-T488 WeakPolarHBondContact CA-OG1 3.4Å; N485-T488 PolarHBondContact O-N 3.11Å; N485-T488 PolarHBondContact O-OG1 2.96Å; N485-T488 VanDerWaalsContact O-OG1 3.11Å; T488-K492 WeakPolarHBondContact O-CB 3.36Å; T488-K492 WeakPolarHBondContact O-CG 3.36Å; T488-K492 PolarHBondContact O-N 3.08Å
489	S	52.4	Low	52	Low	78 Å²	78	113.1 Å²	113.1	55%	0.545	55%	0.546	S	S	.	.	H	α-helix	trans	-65.6	-47.6	175.5	-170.6	0	0	0	0	111.8	N485 Y486 I491 K492 S493	N485-S489 VanDerWaalsContact O-CB 3.27Å; N485-S489 WeakPolarHBondContact O-CB 3.46Å; N485-S489 PolarHBondContact O-N 3.46Å; Y486-S489 PolarHBondContact O-N 3.37Å; S489-I491 PolarHBondContact O-N 3.01Å; S489-K492 PolarHBondContact O-N 2.91Å; S489-S493 PolarHBondContact O-N 3.2Å
490	L	53	Low	52.8	Low	68 Å²	68	111 Å²	111	36%	0.356	54%	0.542	S	S	.	.	H	α-helix	trans	-65.8	-36.7	178.5	-157.8	80.7	0	0	0	112.2	Y486 S493 R494	Y486-L490 VanDerWaalsContact O-CB 3.27Å; Y486-L490 WeakPolarHBondContact O-CB 3.47Å; Y486-L490 PolarHBondContact O-N 2.89Å; L490-S493 PolarHBondContact O-OG 3.11Å; L490-R494 VanDerWaalsContact O-CB 3.25Å; L490-R494 WeakPolarHBondContact O-CB 3.25Å; L490-R494 WeakPolarHBondContact O-CG 3.47Å; L490-R494 PolarHBondContact O-N 2.91Å
491	I	56.7	Low	53.5	Low	84 Å²	84	110.6 Å²	110.6	43%	0.431	54%	0.539	S	S	.	.	H	α-helix	trans	-66.7	-41.1	173	-71.2	166.5	0	0	0	110.8	K487 S489 K495	K487-I491 HydrophobicContact CG-CD1 4.07Å; K487-I491 WeakPolarHBondContact O-CB 3.45Å; K487-I491 WeakPolarHBondContact O-CD1 3.46Å; K487-I491 WeakPolarHBondContact O-CG1 3.39Å; K487-I491 PolarHBondContact O-N 2.92Å; S489-I491 PolarHBondContact O-N 3.01Å; I491-K495 HydrophobicContact CG2-CD 4.36Å; I491-K495 HydrophobicContact CG2-CG 4.49Å; I491-K495 VanDerWaalsContact O-CB 3.27Å; I491-K495 WeakPolarHBondContact O-CB 3.45Å; I491-K495 WeakPolarHBondContact O-CG 3.38Å; I491-K495 PolarHBondContact O-N 3.44Å
492	K	63.8	Low	54	Low	161 Å²	161	110.5 Å²	110.5	70%	0.7	54%	0.539	S	S	*	.	H	α-helix	trans	-66.7	-45.7	176.9	-78.7	-179.1	177.2	-177.2	0	112.1	T488 S489 K495 R496	T488-K492 WeakPolarHBondContact O-CB 3.36Å; T488-K492 WeakPolarHBondContact O-CG 3.36Å; T488-K492 PolarHBondContact O-N 3.08Å; S489-K492 PolarHBondContact O-N 2.91Å; K492-K495 PolarHBondContact O-N 2.91Å; K492-R496 WeakPolarHBondContact O-CB 3.32Å; K492-R496 PolarHBondContact O-N 2.8Å
493	S	55.2	Low	54.9	Low	64 Å²	64	107.8 Å²	107.8	45%	0.448	54%	0.535	S	S	.	.	H	α-helix	trans	-66.3	-41.4	178.7	73	0	0	0	0	112	S489 L490 R496 A497	S489-S493 PolarHBondContact O-N 3.2Å; L490-S493 PolarHBondContact O-OG 3.11Å; S493-R496 WeakPolarHBondContact O-CB 3.49Å; S493-R496 PolarHBondContact O-N 3.41Å; S493-A497 PolarHBondContact O-N 3.3Å
494	R	56	Low	55.1	Low	160 Å²	160	109.9 Å²	109.9	60%	0.604	54%	0.542	S	S	*	.	H	α-helix	trans	-71.6	-35	176.6	-71.1	-179.7	168.4	180	-5.5	113.4	L490 R496 A497 I498	L490-R494 VanDerWaalsContact O-CB 3.25Å; L490-R494 WeakPolarHBondContact O-CB 3.25Å; L490-R494 WeakPolarHBondContact O-CG 3.47Å; L490-R494 PolarHBondContact O-N 2.91Å; R494-R496 VanDerWaalsContact C-N 3.31Å; R494-R496 PolarHBondContact O-N 3.44Å; R494-A497 PolarHBondContact O-N 2.86Å; R494-I498 WeakPolarHBondContact O-CG1 3.49Å; R494-I498 PolarHBondContact O-N 2.67Å
495	K	65.4	Low	55	Low	136 Å²	136	112.2 Å²	112.2	59%	0.591	56%	0.555	S	S	*	*	H	α-helix	trans	-61.1	-40.7	168.3	-83.7	-170.7	173	-170.6	0	111.5	I491 K492 I498 Q499	I491-K495 HydrophobicContact CG2-CD 4.36Å; I491-K495 HydrophobicContact CG2-CG 4.49Å; I491-K495 VanDerWaalsContact O-CB 3.27Å; I491-K495 WeakPolarHBondContact O-CB 3.45Å; I491-K495 WeakPolarHBondContact O-CG 3.38Å; I491-K495 PolarHBondContact O-N 3.44Å; K492-K495 PolarHBondContact O-N 2.91Å; K495-I498 PolarHBondContact O-N 3.03Å; K495-Q499 WeakPolarHBondContact O-CB 3.49Å; K495-Q499 WeakPolarHBondContact O-CG 3.43Å; K495-Q499 PolarHBondContact O-N 3Å
496	R	61.8	Low	55	Low	181 Å²	181	116 Å²	116	68%	0.683	57%	0.566	S	S	*	*	H	α-helix	trans	-65.2	-40.4	175.4	-155.3	178.2	-166.8	-173.3	3.3	111.7	K492 S493 R494 Q499 L500	K492-R496 WeakPolarHBondContact O-CB 3.32Å; K492-R496 PolarHBondContact O-N 2.8Å; S493-R496 WeakPolarHBondContact O-CB 3.49Å; S493-R496 PolarHBondContact O-N 3.41Å; R494-R496 VanDerWaalsContact C-N 3.31Å; R494-R496 PolarHBondContact O-N 3.44Å; R496-Q499 PolarHBondContact O-N 3.29Å; R496-L500 VanDerWaalsContact O-CG 3.29Å; R496-L500 WeakPolarHBondContact O-CG 3.35Å; R496-L500 PolarHBondContact O-N 3.11Å
497	A	58.1	Low	55.6	Low	45 Å²	45	113 Å²	113	37%	0.372	56%	0.561	S	S	.	*	H	α-helix	trans	-63	-43.4	173.7	0	0	0	0	0	112.4	S493 R494 Q499 L500 L501	S493-A497 PolarHBondContact O-N 3.3Å; R494-A497 PolarHBondContact O-N 2.86Å; A497-Q499 VanDerWaalsContact C-N 3.33Å; A497-Q499 PolarHBondContact O-N 3.47Å; A497-L500 PolarHBondContact O-N 3.39Å; A497-L501 WeakPolarHBondContact O-CB 3.42Å; A497-L501 VanDerWaalsContact O-CG 3.31Å; A497-L501 WeakPolarHBondContact O-CG 3.27Å; A497-L501 PolarHBondContact O-N 2.9Å
498	I	59.1	Low	55.9	Low	75 Å²	75	110.4 Å²	110.4	39%	0.385	56%	0.557	S	S	.	*	H	α-helix	trans	-65.6	-36.1	175.1	-67.1	166	0	0	0	111.2	R494 K495 L501 K502	R494-I498 WeakPolarHBondContact O-CG1 3.49Å; R494-I498 PolarHBondContact O-N 2.67Å; K495-I498 PolarHBondContact O-N 3.03Å; I498-L501 PolarHBondContact O-N 2.96Å; I498-K502 WeakPolarHBondContact O-CB 3.33Å; I498-K502 WeakPolarHBondContact O-CG 3.39Å; I498-K502 PolarHBondContact O-N 3.38Å
499	Q	64.4	Low	55.8	Low	135 Å²	135	110.4 Å²	110.4	63%	0.631	55%	0.551	S	S	*	*	H	α-helix	trans	-65.8	-41.8	172.5	-78.1	176.5	-36.6	0	0	112.4	K495 R496 A497 K502 A503	K495-Q499 WeakPolarHBondContact O-CB 3.49Å; K495-Q499 WeakPolarHBondContact O-CG 3.43Å; K495-Q499 PolarHBondContact O-N 3Å; R496-Q499 PolarHBondContact O-N 3.29Å; A497-Q499 VanDerWaalsContact C-N 3.33Å; A497-Q499 PolarHBondContact O-N 3.47Å; Q499-K502 PolarHBondContact O-N 2.91Å; Q499-A503 PolarHBondContact O-N 3.12Å
500	L	58.2	Low	55.8	Low	104 Å²	104	109.3 Å²	109.3	55%	0.545	54%	0.539	S	S	.	.	H	α-helix	trans	-65.1	-39.6	175	-71.5	166.1	0	0	0	111.9	R496 A497 A503	R496-L500 VanDerWaalsContact O-CG 3.29Å; R496-L500 WeakPolarHBondContact O-CG 3.35Å; R496-L500 PolarHBondContact O-N 3.11Å; A497-L500 PolarHBondContact O-N 3.39Å; L500-A503 WeakPolarHBondContact O-CB 3.49Å; L500-A503 PolarHBondContact O-N 3.27Å; L500-A503 VanDerWaalsContact O-N 3.16Å
501	L	54.7	Low	56	Low	105 Å²	105	110.8 Å²	110.8	55%	0.55	55%	0.551	S	S	.	*	H	α-helix	trans	-66.9	-36.6	174.4	-72.2	166.3	0	0	0	112.3	A497 I498 A503 H504	A497-L501 WeakPolarHBondContact O-CB 3.42Å; A497-L501 VanDerWaalsContact O-CG 3.31Å; A497-L501 WeakPolarHBondContact O-CG 3.27Å; A497-L501 PolarHBondContact O-N 2.9Å; I498-L501 PolarHBondContact O-N 2.96Å; L501-A503 VanDerWaalsContact C-N 3.26Å; L501-A503 PolarHBondContact O-N 3.04Å; L501-H504 PolarHBondContact O-N 3.2Å
502	K	55.6	Low	56	Low	122 Å²	122	112.8 Å²	112.8	53%	0.53	56%	0.558	S	S	.	*	H	α-helix	trans	-67.5	-22.5	171.1	-77.9	-170.1	175.4	-162.5	0	113.6	I498 Q499 H504 N505	I498-K502 WeakPolarHBondContact O-CB 3.33Å; I498-K502 WeakPolarHBondContact O-CG 3.39Å; I498-K502 PolarHBondContact O-N 3.38Å; Q499-K502 PolarHBondContact O-N 2.91Å; K502-H504 VanDerWaalsContact C-N 3.35Å; K502-N505 PolarHBondContact O-OD1 3Å
503	A	59.3	Low	55.7	Low	72 Å²	72	110.2 Å²	110.2	60%	0.595	55%	0.551	S	S	*	*	H	α-helix	trans	-78.9	-15.4	177.6	0	0	0	0	0	113.8	Q499 L500 L501	Q499-A503 PolarHBondContact O-N 3.12Å; L500-A503 WeakPolarHBondContact O-CB 3.49Å; L500-A503 PolarHBondContact O-N 3.27Å; L500-A503 VanDerWaalsContact O-N 3.16Å; L501-A503 VanDerWaalsContact C-N 3.26Å; L501-A503 PolarHBondContact O-N 3.04Å
504	H	50.1	Low	55.9	Low	151 Å²	151	111.5 Å²	111.5	70%	0.699	55%	0.55	S	S	*	*	S	Bend	trans	-109	4.4	-172.2	-79.4	-52	0	0	0	116.3	L501 K502 K506	L501-H504 PolarHBondContact O-N 3.2Å; K502-H504 VanDerWaalsContact C-N 3.35Å; H504-K506 VanDerWaalsContact C-N 3.29Å; H504-K506 PolarHBondContact O-N 3.49Å
505	N	42.9	Very low	56.1	Low	142 Å²	142	107.1 Å²	107.1	76%	0.759	54%	0.543	S	S	*	.			trans	44.1	28.4	154.1	-91.9	5.8	0	0	0	120	K502	K502-N505 PolarHBondContact O-OD1 3Å
506	K	48.8	Very low	56.1	Low	186 Å²	186	104.1 Å²	104.1	81%	0.809	54%	0.539	S	S	*	.			trans	-136.1	11.1	-176.1	-84.8	-163.1	174.8	-173.8	0	118.1	H504	H504-K506 VanDerWaalsContact C-N 3.29Å; H504-K506 PolarHBondContact O-N 3.49Å
507	L	49.5	Very low	55.9	Low	111 Å²	111	101.8 Å²	101.8	58%	0.581	53%	0.531	S	S	*	.			trans	-119.5	117.7	179.1	-122.2	76.9	0	0	0	114	H509 L510	L507-H509 PolarHBondContact O-N 3.25Å; L507-H509 VanDerWaalsContact O-N 3.11Å; L507-L510 PolarHBondContact O-N 3.47Å
508	P	52.4	Low	56.5	Low	64 Å²	64	104.3 Å²	104.3	42%	0.416	54%	0.535	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-15.1	176.3	-24.3	34.4	0	0	0	115.4	L510	P508-L510 VanDerWaalsContact C-N 3.33Å; P508-L510 PolarHBondContact O-N 3.48Å
509	H	54.1	Low	57	Low	74 Å²	74	106.3 Å²	106.3	34%	0.343	55%	0.547	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.4	0.2	-174.2	-64	-80.7	0	0	0	114.2	L507 T511 E512 I513	L507-H509 PolarHBondContact O-N 3.25Å; L507-H509 VanDerWaalsContact O-N 3.11Å; H509-T511 VanDerWaalsContact C-N 3.28Å; H509-T511 PolarHBondContact O-N 2.93Å; H509-E512 IonicContact CE1-OE2 2.6Å; H509-E512 IonicContact ND1-OE2 3.02Å; H509-E512 PolarHBondContact ND1-OE2 2.83Å; H509-E512 VanDerWaalsContact ND1-OE2 3.1Å; H509-E512 PolarHBondContact O-N 3.34Å; H509-I513 WeakPolarHBondContact O-CG1 3.38Å; H509-I513 PolarHBondContact O-N 3.3Å
510	L	52.1	Low	57.3	Low	55 Å²	55	105.2 Å²	105.2	29%	0.288	54%	0.544	S	S	.	.	H	α-helix	trans	-55.3	-41.5	175.5	-96.4	160.5	0	0	0	112.6	L507 P508 Q514	L507-L510 PolarHBondContact O-N 3.47Å; P508-L510 VanDerWaalsContact C-N 3.33Å; P508-L510 PolarHBondContact O-N 3.48Å; L510-Q514 VanDerWaalsContact O-CB 3.29Å; L510-Q514 WeakPolarHBondContact O-CB 3.46Å; L510-Q514 PolarHBondContact O-N 3.23Å
511	T	58.8	Low	57.9	Low	100 Å²	100	102.4 Å²	102.4	61%	0.613	53%	0.533	S	S	*	.	H	α-helix	trans	-65.6	-39.1	179.6	-33.8	0	0	0	0	112	H509 Q514 C515	H509-T511 VanDerWaalsContact C-N 3.28Å; H509-T511 PolarHBondContact O-N 2.93Å; T511-Q514 PolarHBondContact O-N 3.45Å; T511-C515 WeakPolarHBondContact O-CB 3.45Å; T511-C515 PolarHBondContact O-N 3.45Å; T511-C515 PolarHBondContact O-SG 3.33Å
512	E	56	Low	58.6	Low	125 Å²	125	103.8 Å²	103.8	58%	0.584	54%	0.537	S	S	*	.	H	α-helix	trans	-72.5	-39.5	-178.2	-168.2	167	-146.1	0	0	111.5	H509 Q514 S516	H509-E512 IonicContact CE1-OE2 2.6Å; H509-E512 IonicContact ND1-OE2 3.02Å; H509-E512 PolarHBondContact ND1-OE2 2.83Å; H509-E512 VanDerWaalsContact ND1-OE2 3.1Å; H509-E512 PolarHBondContact O-N 3.34Å; E512-Q514 VanDerWaalsContact C-N 3.35Å; E512-S516 VanDerWaalsContact O-CB 3.31Å; E512-S516 WeakPolarHBondContact O-CB 3.43Å; E512-S516 PolarHBondContact O-N 2.95Å; E512-S516 PolarHBondContact O-OG 3.47Å
513	I	56.6	Low	59.4	Low	107 Å²	107	105 Å²	105	55%	0.549	54%	0.538	S	S	.	.	H	α-helix	trans	-64.3	-39.8	170.4	-65.2	168.6	0	0	0	110.7	H509 S516 Y517	H509-I513 WeakPolarHBondContact O-CG1 3.38Å; H509-I513 PolarHBondContact O-N 3.3Å; I513-S516 PolarHBondContact O-N 2.99Å; I513-Y517 WeakPolarHBondContact O-CB 3.5Å; I513-Y517 PolarHBondContact O-N 2.88Å
514	Q	61	Low	60	Low	92 Å²	92	106.2 Å²	106.2	43%	0.43	54%	0.535	S	S	.	.	H	α-helix	trans	-68.4	-44.8	179.1	-170	171.9	-33.1	0	0	112	L510 T511 E512 S516 Y517 E518	L510-Q514 VanDerWaalsContact O-CB 3.29Å; L510-Q514 WeakPolarHBondContact O-CB 3.46Å; L510-Q514 PolarHBondContact O-N 3.23Å; T511-Q514 PolarHBondContact O-N 3.45Å; E512-Q514 VanDerWaalsContact C-N 3.35Å; Q514-S516 VanDerWaalsContact C-N 3.33Å; Q514-S516 PolarHBondContact O-N 3.22Å; Q514-Y517 WeakPolarHBondContact O-CB 3.23Å; Q514-Y517 PolarHBondContact O-N 3.21Å; Q514-E518 PolarHBondContact O-N 3.28Å
515	C	59.9	Low	61.1	Low	68 Å²	68	103.6 Å²	103.6	46%	0.459	53%	0.526	S	S	.	.	H	α-helix	trans	-59.3	-42.8	171.7	-72.8	0	0	0	0	112	T511 Y517 E518 L519	T511-C515 WeakPolarHBondContact O-CB 3.45Å; T511-C515 PolarHBondContact O-N 3.45Å; T511-C515 PolarHBondContact O-SG 3.33Å; C515-Y517 VanDerWaalsContact C-N 3.33Å; C515-Y517 PolarHBondContact O-N 3.03Å; C515-E518 PolarHBondContact O-N 3.21Å; C515-L519 WeakPolarHBondContact O-CB 3.38Å; C515-L519 PolarHBondContact O-N 3.12Å
516	S	64.7	Low	62.4	Low	72 Å²	72	100 Å²	100	50%	0.503	51%	0.512	S	S	.	.	H	α-helix	trans	-63	-39.8	176.5	-60.7	0	0	0	0	111.9	E512 I513 Q514 L520	E512-S516 VanDerWaalsContact O-CB 3.31Å; E512-S516 WeakPolarHBondContact O-CB 3.43Å; E512-S516 PolarHBondContact O-N 2.95Å; E512-S516 PolarHBondContact O-OG 3.47Å; I513-S516 PolarHBondContact O-N 2.99Å; Q514-S516 VanDerWaalsContact C-N 3.33Å; Q514-S516 PolarHBondContact O-N 3.22Å; S516-L520 WeakPolarHBondContact O-CB 3.43Å; S516-L520 PolarHBondContact O-N 3.44Å
517	Y	58.3	Low	63.2	Low	132 Å²	132	94.8 Å²	94.8	52%	0.518	49%	0.492	S	S	.	.	H	α-helix	trans	-65.2	-42.5	175.3	174.6	-97.9	0	0	0	112.5	I513 Q514 C515 L520 S521	I513-Y517 WeakPolarHBondContact O-CB 3.5Å; I513-Y517 PolarHBondContact O-N 2.88Å; Q514-Y517 WeakPolarHBondContact O-CB 3.23Å; Q514-Y517 PolarHBondContact O-N 3.21Å; C515-Y517 VanDerWaalsContact C-N 3.33Å; C515-Y517 PolarHBondContact O-N 3.03Å; Y517-L520 PolarHBondContact O-N 2.88Å; Y517-S521 VanDerWaalsContact O-CB 3.25Å; Y517-S521 WeakPolarHBondContact O-CB 3.28Å; Y517-S521 PolarHBondContact O-N 3.04Å
518	E	70.3	Confident	64	Low	98 Å²	98	94 Å²	94	46%	0.458	49%	0.488	S	S	.	.	H	α-helix	trans	-65.2	-44.2	177.1	-74.4	175.2	-165.9	0	0	111.8	Q514 C515 L520 S521 Q522	Q514-E518 PolarHBondContact O-N 3.28Å; C515-E518 PolarHBondContact O-N 3.21Å; E518-L520 PolarHBondContact O-N 3.3Å; E518-S521 PolarHBondContact O-N 3.48Å; E518-Q522 WeakPolarHBondContact O-CB 3.12Å; E518-Q522 WeakPolarHBondContact O-CG 3.48Å; E518-Q522 PolarHBondContact O-N 3.36Å
519	L	69.6	Low	64.5	Low	118 Å²	118	98 Å²	98	62%	0.618	50%	0.502	S	S	*	.	H	α-helix	trans	-58.5	-45.2	172.2	-95.8	156.9	0	0	0	112.5	C515 S521 R523	C515-L519 WeakPolarHBondContact O-CB 3.38Å; C515-L519 PolarHBondContact O-N 3.12Å; L519-S521 VanDerWaalsContact C-N 3.35Å; L519-R523 WeakPolarHBondContact O-CB 3.35Å; L519-R523 PolarHBondContact O-N 2.89Å
520	L	69.5	Low	64.8	Low	112 Å²	112	99.8 Å²	99.8	59%	0.586	51%	0.51	S	S	*	.	H	α-helix	trans	-67.2	-36.5	178.5	-153.3	84.2	0	0	0	111.9	S516 Y517 E518 N524	S516-L520 WeakPolarHBondContact O-CB 3.43Å; S516-L520 PolarHBondContact O-N 3.44Å; Y517-L520 PolarHBondContact O-N 2.88Å; E518-L520 PolarHBondContact O-N 3.3Å; L520-N524 WeakPolarHBondContact O-CB 3.46Å; L520-N524 PolarHBondContact O-N 3.09Å
521	S	71.7	Confident	65.2	Low	45 Å²	45	101.1 Å²	101.1	32%	0.315	52%	0.517	S	S	.	.	H	α-helix	trans	-66.9	-47.4	176.2	-173.7	0	0	0	0	111.7	Y517 E518 L519 R523 N524 N525	Y517-S521 VanDerWaalsContact O-CB 3.25Å; Y517-S521 WeakPolarHBondContact O-CB 3.28Å; Y517-S521 PolarHBondContact O-N 3.04Å; E518-S521 PolarHBondContact O-N 3.48Å; L519-S521 VanDerWaalsContact C-N 3.35Å; S521-R523 VanDerWaalsContact C-N 3.34Å; S521-R523 PolarHBondContact O-N 3.41Å; S521-N524 PolarHBondContact O-N 3Å; S521-N525 VanDerWaalsContact O-CG 3.32Å; S521-N525 PolarHBondContact O-N 3.13Å; S521-N525 PolarHBondContact O-ND2 3.12Å
522	Q	70.1	Confident	65.2	Low	133 Å²	133	100.3 Å²	100.3	62%	0.621	51%	0.512	S	S	*	.	H	α-helix	trans	-58.6	-45.2	173.5	-73.4	178.8	3.2	0	0	111.4	E518 N524 N525 S526	E518-Q522 WeakPolarHBondContact O-CB 3.12Å; E518-Q522 WeakPolarHBondContact O-CG 3.48Å; E518-Q522 PolarHBondContact O-N 3.36Å; Q522-N524 PolarHBondContact O-N 3.17Å; Q522-N525 PolarHBondContact O-N 2.9Å; Q522-S526 WeakPolarHBondContact O-CB 3.28Å; Q522-S526 PolarHBondContact O-N 3.05Å
523	R	71.3	Confident	65	Low	149 Å²	149	96.8 Å²	96.8	56%	0.562	50%	0.503	S	S	*	.	H	α-helix	trans	-64.2	-40.5	178.7	-164.9	171.7	-172.3	161.1	2.5	112.5	L519 S521 S526 L527	L519-R523 WeakPolarHBondContact O-CB 3.35Å; L519-R523 PolarHBondContact O-N 2.89Å; S521-R523 VanDerWaalsContact C-N 3.34Å; S521-R523 PolarHBondContact O-N 3.41Å; R523-S526 PolarHBondContact O-N 3Å; R523-L527 WeakPolarHBondContact O-CB 3.44Å; R523-L527 PolarHBondContact O-N 2.83Å
524	N	73.4	Confident	64.8	Low	96 Å²	96	97.5 Å²	97.5	51%	0.513	50%	0.504	S	S	.	.	H	α-helix	trans	-64.9	-40.8	174	-90.8	-31.4	0	0	0	112.7	L520 S521 Q522 L527 L528	L520-N524 WeakPolarHBondContact O-CB 3.46Å; L520-N524 PolarHBondContact O-N 3.09Å; S521-N524 PolarHBondContact O-N 3Å; Q522-N524 PolarHBondContact O-N 3.17Å; N524-L527 PolarHBondContact O-N 2.75Å; N524-L528 WeakPolarHBondContact O-CB 3.49Å; N524-L528 PolarHBondContact O-N 2.96Å
525	N	72.2	Confident	64.6	Low	96 Å²	96	98.8 Å²	98.8	51%	0.513	51%	0.511	S	S	.	.	H	α-helix	trans	-66.4	-39.3	177	-70.5	-20.6	0	0	0	111.7	S521 Q522 L528 Q529	S521-N525 VanDerWaalsContact O-CG 3.32Å; S521-N525 PolarHBondContact O-N 3.13Å; S521-N525 PolarHBondContact O-ND2 3.12Å; Q522-N525 PolarHBondContact O-N 2.9Å; N525-L528 PolarHBondContact O-N 3.48Å; N525-Q529 PolarHBondContact O-N 3.03Å
526	S	69.9	Low	64.6	Low	66 Å²	66	98.9 Å²	98.9	46%	0.462	51%	0.512	S	S	.	.	H	α-helix	trans	-64.3	-43	174.8	-170	0	0	0	0	112.3	Q522 R523 L528 Q529 Q530	Q522-S526 WeakPolarHBondContact O-CB 3.28Å; Q522-S526 PolarHBondContact O-N 3.05Å; R523-S526 PolarHBondContact O-N 3Å; S526-L528 PolarHBondContact O-N 3.27Å; S526-Q529 PolarHBondContact O-N 2.88Å; S526-Q530 PolarHBondContact O-N 3.38Å
527	L	66.3	Low	64.5	Low	77 Å²	77	100 Å²	100	40%	0.403	51%	0.512	S	S	.	.	H	α-helix	trans	-62.4	-39	172.1	-82	163.6	0	0	0	112.7	R523 N524 Q530 I531	R523-L527 WeakPolarHBondContact O-CB 3.44Å; R523-L527 PolarHBondContact O-N 2.83Å; N524-L527 PolarHBondContact O-N 2.75Å; L527-Q530 PolarHBondContact O-N 3.19Å; L527-I531 WeakPolarHBondContact O-CG1 3.29Å; L527-I531 PolarHBondContact O-N 2.99Å
528	L	65	Low	64.9	Low	96 Å²	96	99.8 Å²	99.8	50%	0.503	52%	0.516	S	S	.	.	H	α-helix	trans	-67.1	-38.7	178.2	-164	72.2	0	0	0	111.6	N524 N525 S526 I531 T532	N524-L528 WeakPolarHBondContact O-CB 3.49Å; N524-L528 PolarHBondContact O-N 2.96Å; N525-L528 PolarHBondContact O-N 3.48Å; S526-L528 PolarHBondContact O-N 3.27Å; L528-I531 PolarHBondContact O-N 3.13Å; L528-T532 PolarHBondContact O-N 3.39Å; L528-T532 PolarHBondContact O-OG1 2.96Å
529	Q	63.7	Low	64.4	Low	148 Å²	148	101.5 Å²	101.5	69%	0.692	52%	0.524	S	S	*	.	H	α-helix	trans	-63.7	-41.1	172.3	-78.4	-177.7	-16.4	0	0	111.9	N525 S526 T532 A533	N525-Q529 PolarHBondContact O-N 3.03Å; S526-Q529 PolarHBondContact O-N 2.88Å; Q529-T532 PolarHBondContact O-N 3.37Å; Q529-A533 WeakPolarHBondContact O-CB 3.49Å; Q529-A533 PolarHBondContact O-N 3.39Å
530	Q	61.6	Low	63.7	Low	111 Å²	111	100.7 Å²	100.7	52%	0.519	52%	0.52	S	S	.	.	H	α-helix	trans	-60.5	-48.3	174.3	-77.2	-176.5	-28.4	0	0	112.4	S526 L527 T532 A533 E534	S526-Q530 PolarHBondContact O-N 3.38Å; L527-Q530 PolarHBondContact O-N 3.19Å; Q530-T532 VanDerWaalsContact C-N 3.29Å; Q530-T532 PolarHBondContact O-N 3.02Å; Q530-A533 PolarHBondContact O-N 3.49Å; Q530-A533 VanDerWaalsContact O-N 3.14Å; Q530-E534 PolarHBondContact O-N 2.88Å
531	I	59.8	Low	63.6	Low	83 Å²	83	100.2 Å²	100.2	43%	0.426	52%	0.518	S	S	.	.	H	α-helix	trans	-61.3	-38.8	178.3	-66.6	165	0	0	0	111.3	L527 L528 E534 Q535	L527-I531 WeakPolarHBondContact O-CG1 3.29Å; L527-I531 PolarHBondContact O-N 2.99Å; L528-I531 PolarHBondContact O-N 3.13Å; I531-E534 PolarHBondContact O-N 3.35Å; I531-Q535 WeakPolarHBondContact O-CG 3.4Å; I531-Q535 PolarHBondContact O-N 2.94Å
532	T	59.5	Low	63.4	Low	83 Å²	83	102.5 Å²	102.5	51%	0.509	53%	0.527	S	S	.	.	H	α-helix	trans	-67.2	-38	177.3	-48.1	0	0	0	0	111.3	L528 Q529 Q530 S536	L528-T532 PolarHBondContact O-N 3.39Å; L528-T532 PolarHBondContact O-OG1 2.96Å; Q529-T532 PolarHBondContact O-N 3.37Å; Q530-T532 VanDerWaalsContact C-N 3.29Å; Q530-T532 PolarHBondContact O-N 3.02Å; T532-S536 PolarHBondContact O-N 3.42Å
533	A	50.3	Low	63.1	Low	50 Å²	50	101 Å²	101	41%	0.413	52%	0.522	S	S	.	.	H	α-helix	trans	-69.5	-37.3	174.8	0	0	0	0	0	112.7	Q529 Q530 S536 N537	Q529-A533 WeakPolarHBondContact O-CB 3.49Å; Q529-A533 PolarHBondContact O-N 3.39Å; Q530-A533 PolarHBondContact O-N 3.49Å; Q530-A533 VanDerWaalsContact O-N 3.14Å; A533-S536 PolarHBondContact O-N 3.38Å; A533-N537 WeakPolarHBondContact O-CB 3.44Å; A533-N537 PolarHBondContact O-N 3.44Å; A533-N537 PolarHBondContact O-ND2 3.39Å
534	E	53.7	Low	62.7	Low	122 Å²	122	97.8 Å²	97.8	57%	0.57	52%	0.519	S	S	*	.	H	α-helix	trans	-62.6	-45.5	172.3	-75.9	-178.8	151.1	0	0	111.5	Q530 I531 S536 N537 Q538	Q530-E534 PolarHBondContact O-N 2.88Å; I531-E534 PolarHBondContact O-N 3.35Å; E534-S536 PolarHBondContact O-N 2.92Å; E534-N537 PolarHBondContact O-N 3.29Å; E534-Q538 PolarHBondContact O-N 2.94Å
535	Q	55.1	Low	62.5	Low	120 Å²	120	99.5 Å²	99.5	56%	0.561	52%	0.524	S	S	*	.	H	α-helix	trans	-60.1	-45.4	174.9	-73.7	178.4	-14.9	0	0	111.8	I531 N537 Q538 E539	I531-Q535 WeakPolarHBondContact O-CG 3.4Å; I531-Q535 PolarHBondContact O-N 2.94Å; Q535-N537 VanDerWaalsContact C-N 3.32Å; Q535-N537 PolarHBondContact O-N 2.95Å; Q535-Q538 WeakPolarHBondContact O-CB 3.41Å; Q535-Q538 PolarHBondContact O-N 3.34Å; Q535-E539 WeakPolarHBondContact O-CG 3.44Å; Q535-E539 PolarHBondContact O-N 3.32Å
536	S	61	Low	62.2	Low	70 Å²	70	97.9 Å²	97.9	49%	0.49	52%	0.52	S	S	.	.	H	α-helix	trans	-62.1	-36.6	175.3	-178.2	0	0	0	0	112.9	T532 A533 E534 L540	T532-S536 PolarHBondContact O-N 3.42Å; A533-S536 PolarHBondContact O-N 3.38Å; E534-S536 PolarHBondContact O-N 2.92Å; S536-L540 VanDerWaalsContact O-CB 3.28Å; S536-L540 WeakPolarHBondContact O-CB 3.31Å; S536-L540 PolarHBondContact O-N 2.99Å
537	N	63.2	Low	61.8	Low	95 Å²	95	98.4 Å²	98.4	51%	0.508	52%	0.517	S	S	.	.	H	α-helix	trans	-69.7	-37.6	174.8	-79.7	-29	0	0	0	112.4	A533 E534 Q535 L540 N541	A533-N537 WeakPolarHBondContact O-CB 3.44Å; A533-N537 PolarHBondContact O-N 3.44Å; A533-N537 PolarHBondContact O-ND2 3.39Å; E534-N537 PolarHBondContact O-N 3.29Å; Q535-N537 VanDerWaalsContact C-N 3.32Å; Q535-N537 PolarHBondContact O-N 2.95Å; N537-L540 PolarHBondContact O-N 3.31Å; N537-N541 WeakPolarHBondContact O-CB 3.24Å; N537-N541 PolarHBondContact O-N 2.78Å
538	Q	65.9	Low	61.9	Low	127 Å²	127	97.8 Å²	97.8	59%	0.593	52%	0.52	S	S	*	.	H	α-helix	trans	-63.3	-45.9	175.1	-160.6	81.9	14.5	0	0	110.8	E534 Q535 N541 N542	E534-Q538 PolarHBondContact O-N 2.94Å; Q535-Q538 WeakPolarHBondContact O-CB 3.41Å; Q535-Q538 PolarHBondContact O-N 3.34Å; Q538-N541 PolarHBondContact O-N 2.76Å; Q538-N542 VanDerWaalsContact O-CG 3.23Å; Q538-N542 PolarHBondContact O-N 2.96Å; Q538-N542 PolarHBondContact O-ND2 3.04Å
539	E	60.2	Low	62.1	Low	135 Å²	135	95.8 Å²	95.8	63%	0.631	51%	0.514	S	S	*	.	H	α-helix	trans	-62.7	-43.1	174.6	-72.2	-179.3	177	0	0	112	Q535 N541 N542 L543	Q535-E539 WeakPolarHBondContact O-CG 3.44Å; Q535-E539 PolarHBondContact O-N 3.32Å; E539-N541 PolarHBondContact O-N 3.46Å; E539-N542 PolarHBondContact O-N 2.97Å; E539-L543 WeakPolarHBondContact O-CB 3.36Å; E539-L543 PolarHBondContact O-N 3.06Å
540	L	55.3	Low	62.3	Low	100 Å²	100	93.7 Å²	93.7	52%	0.524	51%	0.505	S	S	.	.	H	α-helix	trans	-62.2	-43	177.2	-170.1	70.5	0	0	0	111.6	S536 N537 L543 V544	S536-L540 VanDerWaalsContact O-CB 3.28Å; S536-L540 WeakPolarHBondContact O-CB 3.31Å; S536-L540 PolarHBondContact O-N 2.99Å; N537-L540 PolarHBondContact O-N 3.31Å; L540-L543 PolarHBondContact O-N 2.91Å; L540-V544 WeakPolarHBondContact O-CB 3.47Å; L540-V544 VanDerWaalsContact O-CG2 3.27Å; L540-V544 WeakPolarHBondContact O-CG2 3.49Å; L540-V544 PolarHBondContact O-N 3.16Å
541	N	65.8	Low	62.5	Low	102 Å²	102	92.7 Å²	92.7	55%	0.545	50%	0.503	S	S	.	.	H	α-helix	trans	-61.8	-47.8	175.5	-83.1	-18.5	0	0	0	111.7	N537 Q538 E539 L543 V544 E545	N537-N541 WeakPolarHBondContact O-CB 3.24Å; N537-N541 PolarHBondContact O-N 2.78Å; Q538-N541 PolarHBondContact O-N 2.76Å; E539-N541 PolarHBondContact O-N 3.46Å; N541-L543 PolarHBondContact O-N 3.24Å; N541-V544 PolarHBondContact O-N 3.34Å; N541-E545 WeakPolarHBondContact O-CB 3.38Å; N541-E545 PolarHBondContact O-N 2.8Å
542	N	69.1	Low	62.9	Low	94 Å²	94	94.7 Å²	94.7	50%	0.503	51%	0.51	S	S	.	.	H	α-helix	trans	-57.8	-39.1	175.8	-68.8	-19.2	0	0	0	111.8	Q538 E539 S546	Q538-N542 VanDerWaalsContact O-CG 3.23Å; Q538-N542 PolarHBondContact O-N 2.96Å; Q538-N542 PolarHBondContact O-ND2 3.04Å; E539-N542 PolarHBondContact O-N 2.97Å; N542-S546 VanDerWaalsContact O-CB 3.29Å; N542-S546 WeakPolarHBondContact O-CB 3.5Å; N542-S546 PolarHBondContact O-N 2.93Å
543	L	62.6	Low	63.4	Low	100 Å²	100	98.4 Å²	98.4	52%	0.524	52%	0.515	S	S	.	.	H	α-helix	trans	-74.3	-35.3	-179.6	-155	147.8	0	0	0	112	E539 L540 N541 L547	E539-L543 WeakPolarHBondContact O-CB 3.36Å; E539-L543 PolarHBondContact O-N 3.06Å; L540-L543 PolarHBondContact O-N 2.91Å; N541-L543 PolarHBondContact O-N 3.24Å; L543-L547 HydrophobicContact CD2-CD1 3.77Å; L543-L547 HydrophobicContact CD2-CG 4.45Å; L543-L547 WeakPolarHBondContact O-CB 3.39Å; L543-L547 WeakPolarHBondContact O-CG 3.47Å; L543-L547 PolarHBondContact O-N 3.32Å
544	V	64.1	Low	64.3	Low	82 Å²	82	99.1 Å²	99.1	50%	0.497	52%	0.517	S	S	.	.	H	α-helix	trans	-65.6	-42.5	170.9	166.8	0	0	0	0	111.5	L540 N541 L547 S548	L540-V544 WeakPolarHBondContact O-CB 3.47Å; L540-V544 VanDerWaalsContact O-CG2 3.27Å; L540-V544 WeakPolarHBondContact O-CG2 3.49Å; L540-V544 PolarHBondContact O-N 3.16Å; N541-V544 PolarHBondContact O-N 3.34Å; V544-L547 PolarHBondContact O-N 3.4Å; V544-S548 WeakPolarHBondContact O-CB 3.49Å; V544-S548 PolarHBondContact O-N 3.36Å
545	E	67.4	Low	65	Low	132 Å²	132	100.5 Å²	100.5	62%	0.617	52%	0.517	S	S	*	.	H	α-helix	trans	-70.9	-36.6	179.6	-169.2	156.1	-145.9	0	0	112	N541 S548 S549	N541-E545 WeakPolarHBondContact O-CB 3.38Å; N541-E545 PolarHBondContact O-N 2.8Å; E545-S548 PolarHBondContact O-N 2.91Å; E545-S549 WeakPolarHBondContact O-CB 3.31Å; E545-S549 PolarHBondContact O-N 2.79Å; E545-S549 PolarHBondContact O-OG 3.13Å
546	S	66.9	Low	65.9	Low	62 Å²	62	102.4 Å²	102.4	43%	0.434	52%	0.523	S	S	.	.	H	α-helix	trans	-63.2	-45.1	169.2	-176.6	0	0	0	0	112.3	N542 S549 M550	N542-S546 VanDerWaalsContact O-CB 3.29Å; N542-S546 WeakPolarHBondContact O-CB 3.5Å; N542-S546 PolarHBondContact O-N 2.93Å; S546-S549 PolarHBondContact O-N 3.03Å; S546-M550 PolarHBondContact O-N 3.03Å
547	L	62.3	Low	66.4	Low	77 Å²	77	105.3 Å²	105.3	40%	0.403	53%	0.529	S	S	.	.	H	α-helix	trans	-60.6	-45.3	173.1	-87.3	164.9	0	0	0	112	L543 V544 S549 M550 L551	L543-L547 HydrophobicContact CD2-CD1 3.77Å; L543-L547 HydrophobicContact CD2-CG 4.45Å; L543-L547 WeakPolarHBondContact O-CB 3.39Å; L543-L547 WeakPolarHBondContact O-CG 3.47Å; L543-L547 PolarHBondContact O-N 3.32Å; V544-L547 PolarHBondContact O-N 3.4Å; L547-S549 VanDerWaalsContact C-N 3.32Å; L547-S549 PolarHBondContact O-N 2.75Å; L547-M550 HydrophobicContact CD2-CE 4.11Å; L547-M550 PolarHBondContact O-N 3.2Å; L547-L551 VanDerWaalsContact O-CB 3.32Å; L547-L551 WeakPolarHBondContact O-CB 3.44Å; L547-L551 PolarHBondContact O-N 3.41Å
548	S	66.8	Low	66.9	Low	65 Å²	65	106.1 Å²	106.1	46%	0.455	53%	0.534	S	S	.	.	H	α-helix	trans	-58.3	-45.5	176	-171.9	0	0	0	0	111.1	V544 E545 M550 L551 H552	V544-S548 WeakPolarHBondContact O-CB 3.49Å; V544-S548 PolarHBondContact O-N 3.36Å; E545-S548 PolarHBondContact O-N 2.91Å; S548-M550 PolarHBondContact O-N 2.87Å; S548-L551 PolarHBondContact O-N 3.37Å; S548-H552 PolarHBondContact O-N 3.28Å
549	S	70.2	Confident	67.2	Low	54 Å²	54	104.7 Å²	104.7	38%	0.378	53%	0.529	S	S	.	.	H	α-helix	trans	-65	-37.3	176.9	-63.4	0	0	0	0	113.4	E545 S546 L547 R553	E545-S549 WeakPolarHBondContact O-CB 3.31Å; E545-S549 PolarHBondContact O-N 2.79Å; E545-S549 PolarHBondContact O-OG 3.13Å; S546-S549 PolarHBondContact O-N 3.03Å; L547-S549 VanDerWaalsContact C-N 3.32Å; L547-S549 PolarHBondContact O-N 2.75Å; S549-R553 WeakPolarHBondContact O-CB 3.26Å; S549-R553 WeakPolarHBondContact O-CG 3.47Å; S549-R553 PolarHBondContact O-N 2.97Å; S549-R553 VanDerWaalsContact O-N 3.11Å; S549-R553 PolarHBondContact O-NE 3.36Å
550	M	66.7	Low	67.7	Low	104 Å²	104	104.3 Å²	104.3	51%	0.512	53%	0.527	S	S	.	.	H	α-helix	trans	-65.5	-43.5	170.5	-93.4	-166.5	-71.2	0	0	111.8	S546 L547 S548 R553 S554	S546-M550 PolarHBondContact O-N 3.03Å; L547-M550 HydrophobicContact CD2-CE 4.11Å; L547-M550 PolarHBondContact O-N 3.2Å; S548-M550 PolarHBondContact O-N 2.87Å; M550-R553 PolarHBondContact O-N 3.15Å; M550-S554 WeakPolarHBondContact O-CB 3.47Å; M550-S554 PolarHBondContact O-N 2.99Å
551	L	66.8	Low	68.1	Low	90 Å²	90	101.9 Å²	101.9	47%	0.471	52%	0.521	S	S	.	.	H	α-helix	trans	-70.4	-34.8	-176.6	-152	150.8	0	0	0	111.1	L547 S548 R555	L547-L551 VanDerWaalsContact O-CB 3.32Å; L547-L551 WeakPolarHBondContact O-CB 3.44Å; L547-L551 PolarHBondContact O-N 3.41Å; S548-L551 PolarHBondContact O-N 3.37Å; L551-R555 HydrophobicContact CD2-CG 4.32Å; L551-R555 WeakPolarHBondContact O-CB 3.42Å; L551-R555 WeakPolarHBondContact O-CG 3.45Å; L551-R555 PolarHBondContact O-N 2.77Å
552	H	68.7	Low	68.5	Low	124 Å²	124	103 Å²	103	57%	0.574	52%	0.522	S	S	*	.	H	α-helix	trans	-63.5	-45	167.7	-103.9	-79.1	0	0	0	112.7	S548 R555 K556	S548-H552 PolarHBondContact O-N 3.28Å; H552-R555 PolarHBondContact O-N 3.18Å; H552-K556 PolarHBondContact O-N 3.13Å
553	R	69.5	Low	68.8	Low	161 Å²	161	107.4 Å²	107.4	61%	0.608	53%	0.531	S	S	*	.	H	α-helix	trans	-61.4	-45.3	175.3	-79.4	-175.4	-88.6	-166.2	-3.6	111.9	S549 M550 K556 Q557	S549-R553 WeakPolarHBondContact O-CB 3.26Å; S549-R553 WeakPolarHBondContact O-CG 3.47Å; S549-R553 PolarHBondContact O-N 2.97Å; S549-R553 VanDerWaalsContact O-N 3.11Å; S549-R553 PolarHBondContact O-NE 3.36Å; M550-R553 PolarHBondContact O-N 3.15Å; R553-K556 PolarHBondContact O-N 2.92Å; R553-Q557 WeakPolarHBondContact O-CG 3.38Å; R553-Q557 PolarHBondContact O-N 3.11Å
554	S	68.6	Low	69.3	Low	66 Å²	66	106.2 Å²	106.2	46%	0.462	53%	0.528	S	S	.	.	H	α-helix	trans	-61.4	-43.8	176.2	179.8	0	0	0	0	112.3	M550 K556 Q557 N558	M550-S554 WeakPolarHBondContact O-CB 3.47Å; M550-S554 PolarHBondContact O-N 2.99Å; S554-K556 PolarHBondContact O-N 2.92Å; S554-Q557 PolarHBondContact O-N 3.2Å; S554-N558 WeakPolarHBondContact O-CB 3.44Å; S554-N558 PolarHBondContact O-N 3.33Å
555	R	69.7	Low	69.8	Low	151 Å²	151	106.8 Å²	106.8	57%	0.57	53%	0.527	S	S	*	.	H	α-helix	trans	-60.7	-42.9	173.4	-77.9	176	176	170.7	0.9	112.2	L551 H552 N558 I559	L551-R555 HydrophobicContact CD2-CG 4.32Å; L551-R555 WeakPolarHBondContact O-CB 3.42Å; L551-R555 WeakPolarHBondContact O-CG 3.45Å; L551-R555 PolarHBondContact O-N 2.77Å; H552-R555 PolarHBondContact O-N 3.18Å; R555-N558 PolarHBondContact O-N 3.32Å; R555-I559 WeakPolarHBondContact O-CG1 3.49Å; R555-I559 PolarHBondContact O-N 3.47Å
556	K	73.3	Confident	70.1	Confident	159 Å²	159	104.1 Å²	104.1	69%	0.691	52%	0.515	S	S	*	.	H	α-helix	trans	-62.4	-44.5	177.3	-169.4	177	-179.5	-179.4	0	111.5	H552 R553 S554 I559 Q560	H552-K556 PolarHBondContact O-N 3.13Å; R553-K556 PolarHBondContact O-N 2.92Å; S554-K556 PolarHBondContact O-N 2.92Å; K556-I559 PolarHBondContact O-N 3.25Å; K556-Q560 WeakPolarHBondContact O-CB 3.42Å; K556-Q560 PolarHBondContact O-N 3.48Å
557	Q	71.9	Confident	70.6	Confident	132 Å²	132	103.9 Å²	103.9	62%	0.617	51%	0.513	S	S	*	.	H	α-helix	trans	-62.2	-41.8	174.4	-73.6	173.4	-26.5	0	0	112.4	R553 S554 Q560 A561	R553-Q557 WeakPolarHBondContact O-CG 3.38Å; R553-Q557 PolarHBondContact O-N 3.11Å; S554-Q557 PolarHBondContact O-N 3.2Å; Q557-Q560 PolarHBondContact O-N 3.32Å; Q557-A561 WeakPolarHBondContact O-CB 3.49Å; Q557-A561 PolarHBondContact O-N 3.11Å
558	N	72.2	Confident	71.3	Confident	112 Å²	112	104.7 Å²	104.7	60%	0.599	52%	0.517	S	S	*	.	H	α-helix	trans	-65.6	-42.8	178.2	-167.1	-32.6	0	0	0	111.8	S554 R555 Q560 A561 K562	S554-N558 WeakPolarHBondContact O-CB 3.44Å; S554-N558 PolarHBondContact O-N 3.33Å; R555-N558 PolarHBondContact O-N 3.32Å; N558-Q560 VanDerWaalsContact C-N 3.32Å; N558-Q560 PolarHBondContact O-N 3.23Å; N558-A561 PolarHBondContact O-N 3.23Å; N558-K562 WeakPolarHBondContact O-CB 3.32Å; N558-K562 PolarHBondContact O-N 3.47Å
559	I	72.7	Confident	71.8	Confident	97 Å²	97	106.6 Å²	106.6	50%	0.497	52%	0.517	S	S	.	.	H	α-helix	trans	-60.6	-42	173.1	-68	164.7	0	0	0	111.2	R555 K556 K562 R563	R555-I559 WeakPolarHBondContact O-CG1 3.49Å; R555-I559 PolarHBondContact O-N 3.47Å; K556-I559 PolarHBondContact O-N 3.25Å; I559-K562 PolarHBondContact O-N 3.1Å; I559-R563 WeakPolarHBondContact O-CG 3.36Å; I559-R563 PolarHBondContact O-N 2.77Å
560	Q	70.5	Confident	72.1	Confident	127 Å²	127	109.2 Å²	109.2	59%	0.593	52%	0.524	S	S	*	.	H	α-helix	trans	-64.6	-48.7	176.8	-173.5	172.3	-3.8	0	0	111.4	K556 Q557 N558 K562 R563 T564	K556-Q560 WeakPolarHBondContact O-CB 3.42Å; K556-Q560 PolarHBondContact O-N 3.48Å; Q557-Q560 PolarHBondContact O-N 3.32Å; N558-Q560 VanDerWaalsContact C-N 3.32Å; N558-Q560 PolarHBondContact O-N 3.23Å; Q560-K562 VanDerWaalsContact C-N 3.31Å; Q560-K562 PolarHBondContact O-N 3.06Å; Q560-R563 WeakPolarHBondContact O-CB 3.49Å; Q560-R563 PolarHBondContact O-N 3.24Å; Q560-R563 VanDerWaalsContact O-N 3.13Å; Q560-T564 PolarHBondContact O-N 2.94Å; Q560-T564 PolarHBondContact O-OG1 3.47Å; Q560-T564 VanDerWaalsContact O-OG1 3.13Å
561	A	64.3	Low	72.6	Confident	48 Å²	48	110 Å²	110	40%	0.397	53%	0.526	S	S	.	.	H	α-helix	trans	-58.3	-41	176	0	0	0	0	0	112.1	Q557 N558 T564 I565	Q557-A561 WeakPolarHBondContact O-CB 3.49Å; Q557-A561 PolarHBondContact O-N 3.11Å; N558-A561 PolarHBondContact O-N 3.23Å; A561-T564 PolarHBondContact O-N 3.45Å; A561-I565 WeakPolarHBondContact O-CG1 3.46Å; A561-I565 PolarHBondContact O-N 3.14Å
562	K	75.2	Confident	73.1	Confident	127 Å²	127	110.4 Å²	110.4	55%	0.552	53%	0.529	S	S	*	.	H	α-helix	trans	-62.3	-43.7	175	-170	176.5	-179.3	-176.9	0	111.9	N558 I559 Q560 T564 I565 E566	N558-K562 WeakPolarHBondContact O-CB 3.32Å; N558-K562 PolarHBondContact O-N 3.47Å; I559-K562 PolarHBondContact O-N 3.1Å; Q560-K562 VanDerWaalsContact C-N 3.31Å; Q560-K562 PolarHBondContact O-N 3.06Å; K562-T564 VanDerWaalsContact C-N 3.33Å; K562-T564 PolarHBondContact O-N 3.33Å; K562-I565 PolarHBondContact O-N 3.05Å; K562-E566 WeakPolarHBondContact CE-OE2 3.4Å; K562-E566 PolarHBondContact O-N 3.47Å
563	R	74.7	Confident	73.6	Confident	186 Å²	186	108.3 Å²	108.3	70%	0.702	52%	0.521	S	S	*	.	H	α-helix	trans	-61.3	-39.9	173.9	-71.8	175.1	178.7	-177.6	-1.6	112.1	I559 Q560 E566 S567	I559-R563 WeakPolarHBondContact O-CG 3.36Å; I559-R563 PolarHBondContact O-N 2.77Å; Q560-R563 WeakPolarHBondContact O-CB 3.49Å; Q560-R563 PolarHBondContact O-N 3.24Å; Q560-R563 VanDerWaalsContact O-N 3.13Å; R563-E566 PolarHBondContact O-N 3.41Å; R563-S567 WeakPolarHBondContact O-CB 3.29Å; R563-S567 PolarHBondContact O-N 2.93Å
564	T	73.8	Confident	74	Confident	75 Å²	75	107.1 Å²	107.1	46%	0.46	52%	0.52	S	S	.	.	H	α-helix	trans	-64.1	-42.8	174.7	-53.2	0	0	0	0	111.5	Q560 A561 K562 S567 I568	Q560-T564 PolarHBondContact O-N 2.94Å; Q560-T564 PolarHBondContact O-OG1 3.47Å; Q560-T564 VanDerWaalsContact O-OG1 3.13Å; A561-T564 PolarHBondContact O-N 3.45Å; K562-T564 VanDerWaalsContact C-N 3.33Å; K562-T564 PolarHBondContact O-N 3.33Å; T564-S567 WeakPolarHBondContact O-CB 3.35Å; T564-S567 PolarHBondContact O-N 2.87Å; T564-I568 HydrophobicContact CG2-CD1 4.03Å; T564-I568 VanDerWaalsContact O-CG1 3.3Å; T564-I568 WeakPolarHBondContact O-CG1 3.47Å; T564-I568 PolarHBondContact O-N 3.25Å
565	I	73.3	Confident	74.4	Confident	93 Å²	93	108.8 Å²	108.8	48%	0.477	52%	0.523	S	S	.	.	H	α-helix	trans	-63.2	-45.2	175.7	-70.1	164.2	0	0	0	111.3	A561 K562 S567 I568 K569	A561-I565 WeakPolarHBondContact O-CG1 3.46Å; A561-I565 PolarHBondContact O-N 3.14Å; K562-I565 PolarHBondContact O-N 3.05Å; I565-S567 VanDerWaalsContact C-N 3.32Å; I565-S567 PolarHBondContact O-N 3.33Å; I565-I568 PolarHBondContact O-N 2.89Å; I565-K569 WeakPolarHBondContact O-CG 3.45Å; I565-K569 PolarHBondContact O-N 2.97Å
566	E	74.3	Confident	74.8	Confident	77 Å²	77	107 Å²	107	36%	0.36	52%	0.521	S	S	.	.	H	α-helix	trans	-62.5	-39	175.7	-118.1	73.3	-105.6	0	0	111.4	K562 R563 K569 M570	K562-E566 WeakPolarHBondContact CE-OE2 3.4Å; K562-E566 PolarHBondContact O-N 3.47Å; R563-E566 PolarHBondContact O-N 3.41Å; E566-K569 PolarHBondContact O-N 3.08Å; E566-K569 IonicContact OE1-NZ 2.9Å; E566-K569 PolarHBondContact OE1-NZ 3.18Å; E566-M570 WeakPolarHBondContact O-CG 3.4Å; E566-M570 PolarHBondContact O-N 2.94Å
567	S	77.8	Confident	75	Confident	57 Å²	57	102.7 Å²	102.7	40%	0.399	51%	0.506	S	S	.	.	H	α-helix	trans	-62.9	-44.3	173.2	-174.1	0	0	0	0	112.2	R563 T564 I565 K569 M570 H571	R563-S567 WeakPolarHBondContact O-CB 3.29Å; R563-S567 PolarHBondContact O-N 2.93Å; T564-S567 WeakPolarHBondContact O-CB 3.35Å; T564-S567 PolarHBondContact O-N 2.87Å; I565-S567 VanDerWaalsContact C-N 3.32Å; I565-S567 PolarHBondContact O-N 3.33Å; S567-K569 PolarHBondContact O-N 3.33Å; S567-M570 PolarHBondContact O-N 2.98Å; S567-H571 PolarHBondContact O-N 3.36Å; S567-H571 PolarHBondContact O-ND1 3.48Å
568	I	76.5	Confident	75.2	Confident	93 Å²	93	100 Å²	100	48%	0.477	50%	0.499	S	S	.	.	H	α-helix	trans	-62.2	-42.8	176	-69.8	164.4	0	0	0	110.6	T564 I565 M570 H571 L572	T564-I568 HydrophobicContact CG2-CD1 4.03Å; T564-I568 VanDerWaalsContact O-CG1 3.3Å; T564-I568 WeakPolarHBondContact O-CG1 3.47Å; T564-I568 PolarHBondContact O-N 3.25Å; I565-I568 PolarHBondContact O-N 2.89Å; I568-M570 VanDerWaalsContact C-N 3.35Å; I568-M570 PolarHBondContact O-N 2.88Å; I568-H571 PolarHBondContact O-N 3.1Å; I568-L572 HydrophobicContact CG2-CD1 3.9Å; I568-L572 HydrophobicContact CG2-CG 4.33Å; I568-L572 WeakPolarHBondContact O-CG 3.47Å; I568-L572 PolarHBondContact O-N 3.5Å
569	K	77.9	Confident	75.4	Confident	105 Å²	105	98.7 Å²	98.7	46%	0.457	49%	0.491	S	S	.	.	H	α-helix	trans	-58.1	-44.6	173.6	-72.9	177.6	-174.6	170.7	0	112.1	I565 E566 S567 H571 L572 I573	I565-K569 WeakPolarHBondContact O-CG 3.45Å; I565-K569 PolarHBondContact O-N 2.97Å; E566-K569 PolarHBondContact O-N 3.08Å; E566-K569 IonicContact OE1-NZ 2.9Å; E566-K569 PolarHBondContact OE1-NZ 3.18Å; S567-K569 PolarHBondContact O-N 3.33Å; K569-H571 VanDerWaalsContact C-N 3.31Å; K569-H571 PolarHBondContact O-N 2.92Å; K569-L572 PolarHBondContact O-N 3.36Å; K569-I573 VanDerWaalsContact O-CG1 3.31Å; K569-I573 WeakPolarHBondContact O-CG1 3.42Å; K569-I573 PolarHBondContact O-N 3.36Å
570	M	75.8	Confident	75.6	Confident	109 Å²	109	99.1 Å²	99.1	54%	0.537	49%	0.489	S	S	.	.	H	α-helix	trans	-63.3	-36.4	177.4	-70.8	-57.6	-58.7	0	0	112.4	E566 S567 I568 I573 K574	E566-M570 WeakPolarHBondContact O-CG 3.4Å; E566-M570 PolarHBondContact O-N 2.94Å; S567-M570 PolarHBondContact O-N 2.98Å; I568-M570 VanDerWaalsContact C-N 3.35Å; I568-M570 PolarHBondContact O-N 2.88Å; M570-I573 HydrophobicContact SD-CD1 4.45Å; M570-K574 WeakPolarHBondContact O-CG 3.49Å; M570-K574 PolarHBondContact O-N 3.25Å
571	H	77.4	Confident	75.8	Confident	120 Å²	120	98.2 Å²	98.2	56%	0.556	49%	0.485	S	S	*	.	H	α-helix	trans	-69.6	-39.2	173.3	-72.6	86.6	0	0	0	112.2	S567 I568 K569 K574 L575	S567-H571 PolarHBondContact O-N 3.36Å; S567-H571 PolarHBondContact O-ND1 3.48Å; I568-H571 PolarHBondContact O-N 3.1Å; K569-H571 VanDerWaalsContact C-N 3.31Å; K569-H571 PolarHBondContact O-N 2.92Å; H571-K574 PolarHBondContact O-N 3.48Å; H571-L575 WeakPolarHBondContact O-CB 3.45Å; H571-L575 PolarHBondContact O-N 2.98Å
572	L	77	Confident	76.2	Confident	100 Å²	100	100.6 Å²	100.6	52%	0.524	49%	0.491	S	S	.	.	H	α-helix	trans	-64.8	-39.3	175	-73.4	169	0	0	0	112.4	I568 K569 L575 Q576	I568-L572 HydrophobicContact CG2-CD1 3.9Å; I568-L572 HydrophobicContact CG2-CG 4.33Å; I568-L572 WeakPolarHBondContact O-CG 3.47Å; I568-L572 PolarHBondContact O-N 3.5Å; K569-L572 PolarHBondContact O-N 3.36Å; L572-L575 PolarHBondContact O-N 3.48Å; L572-Q576 WeakPolarHBondContact O-CB 3.42Å; L572-Q576 PolarHBondContact O-N 3.22Å
573	I	79.4	Confident	76.2	Confident	79 Å²	79	99 Å²	99	41%	0.405	49%	0.488	S	S	.	.	H	α-helix	trans	-63.8	-48.8	174.1	-68.5	163.5	0	0	0	110	K569 M570 L575 Q576 D577	K569-I573 VanDerWaalsContact O-CG1 3.31Å; K569-I573 WeakPolarHBondContact O-CG1 3.42Å; K569-I573 PolarHBondContact O-N 3.36Å; M570-I573 HydrophobicContact SD-CD1 4.45Å; I573-L575 VanDerWaalsContact C-N 3.32Å; I573-L575 PolarHBondContact O-N 3.46Å; I573-Q576 WeakPolarHBondContact O-CB 3.37Å; I573-Q576 PolarHBondContact O-N 3.43Å; I573-Q576 VanDerWaalsContact O-N 3.13Å; I573-D577 PolarHBondContact O-N 2.95Å
574	K	78.2	Confident	76.1	Confident	137 Å²	137	95.4 Å²	95.4	60%	0.596	48%	0.481	S	S	*	.	H	α-helix	trans	-55.4	-47	174.5	-77.7	-176.5	174.8	-170.2	0	112	M570 H571 Q576 D577 T578	M570-K574 WeakPolarHBondContact O-CG 3.49Å; M570-K574 PolarHBondContact O-N 3.25Å; H571-K574 PolarHBondContact O-N 3.48Å; K574-Q576 VanDerWaalsContact C-N 3.33Å; K574-Q576 PolarHBondContact O-N 2.87Å; K574-D577 PolarHBondContact O-N 3.02Å; K574-T578 PolarHBondContact O-N 3.01Å; K574-T578 PolarHBondContact O-OG1 2.94Å
575	L	76.4	Confident	76	Confident	101 Å²	101	95.9 Å²	95.9	53%	0.529	48%	0.477	S	S	.	.	H	α-helix	trans	-59.7	-44.1	177.1	-169.2	78.5	0	0	0	111.4	H571 L572 I573 D577 T578 I579	H571-L575 WeakPolarHBondContact O-CB 3.45Å; H571-L575 PolarHBondContact O-N 2.98Å; L572-L575 PolarHBondContact O-N 3.48Å; I573-L575 VanDerWaalsContact C-N 3.32Å; I573-L575 PolarHBondContact O-N 3.46Å; L575-D577 PolarHBondContact O-N 2.96Å; L575-T578 PolarHBondContact O-N 2.91Å; L575-I579 HydrophobicContact CD2-CD1 4.47Å; L575-I579 HydrophobicContact CG-CD1 4.09Å; L575-I579 VanDerWaalsContact O-CG1 3.26Å; L575-I579 WeakPolarHBondContact O-CG1 3.35Å; L575-I579 PolarHBondContact O-N 3.27Å
576	Q	77.8	Confident	75.7	Confident	112 Å²	112	96 Å²	96	52%	0.523	48%	0.479	S	S	.	.	H	α-helix	trans	-62.9	-41	177.7	-173.4	178.7	9.7	0	0	112	L572 I573 K574 I579 K580	L572-Q576 WeakPolarHBondContact O-CB 3.42Å; L572-Q576 PolarHBondContact O-N 3.22Å; I573-Q576 WeakPolarHBondContact O-CB 3.37Å; I573-Q576 PolarHBondContact O-N 3.43Å; I573-Q576 VanDerWaalsContact O-N 3.13Å; K574-Q576 VanDerWaalsContact C-N 3.33Å; K574-Q576 PolarHBondContact O-N 2.87Å; Q576-I579 PolarHBondContact O-N 2.99Å; Q576-K580 WeakPolarHBondContact O-CG 3.48Å; Q576-K580 PolarHBondContact O-N 3Å
577	D	78.3	Confident	75.2	Confident	70 Å²	70	97.4 Å²	97.4	37%	0.374	49%	0.489	S	S	.	.	H	α-helix	trans	-71.3	-36.6	177	-66.2	-29.7	0	0	0	111.7	I573 K574 L575 I579 K580 Q581	I573-D577 PolarHBondContact O-N 2.95Å; K574-D577 PolarHBondContact O-N 3.02Å; L575-D577 PolarHBondContact O-N 2.96Å; D577-I579 PolarHBondContact O-N 2.73Å; D577-K580 PolarHBondContact O-N 3.07Å; D577-K580 IonicContact OD1-NZ 2.67Å; D577-K580 PolarHBondContact OD1-NZ 3.17Å; D577-Q581 WeakPolarHBondContact O-CB 3.5Å; D577-Q581 PolarHBondContact O-N 3.26Å
578	T	77	Confident	74.4	Confident	75 Å²	75	100.8 Å²	100.8	46%	0.46	50%	0.498	S	S	.	.	H	α-helix	trans	-61.7	-41.2	170.1	-48.6	0	0	0	0	111.7	K574 L575 Q581 L582	K574-T578 PolarHBondContact O-N 3.01Å; K574-T578 PolarHBondContact O-OG1 2.94Å; L575-T578 PolarHBondContact O-N 2.91Å; T578-Q581 PolarHBondContact O-N 3.11Å; T578-L582 HydrophobicContact CG2-CD1 4.28Å; T578-L582 WeakPolarHBondContact O-CB 3.21Å; T578-L582 WeakPolarHBondContact O-CG 3.29Å; T578-L582 PolarHBondContact O-N 3.08Å
579	I	75.5	Confident	73.4	Confident	85 Å²	85	100.4 Å²	100.4	44%	0.436	50%	0.497	S	S	.	.	H	α-helix	trans	-64.6	-40.4	175.6	-70.7	163.7	0	0	0	111.4	L575 Q576 D577 N583	L575-I579 HydrophobicContact CD2-CD1 4.47Å; L575-I579 HydrophobicContact CG-CD1 4.09Å; L575-I579 VanDerWaalsContact O-CG1 3.26Å; L575-I579 WeakPolarHBondContact O-CG1 3.35Å; L575-I579 PolarHBondContact O-N 3.27Å; Q576-I579 PolarHBondContact O-N 2.99Å; D577-I579 PolarHBondContact O-N 2.73Å; I579-N583 WeakPolarHBondContact O-CB 3.48Å; I579-N583 PolarHBondContact O-N 3.28Å
580	K	76.2	Confident	72.1	Confident	106 Å²	106	98.8 Å²	98.8	46%	0.461	50%	0.495	S	S	.	.	H	α-helix	trans	-62.5	-43.7	173.3	-71	173.4	-165.4	154.6	0	111.6	Q576 D577 N583 M584	Q576-K580 WeakPolarHBondContact O-CG 3.48Å; Q576-K580 PolarHBondContact O-N 3Å; D577-K580 PolarHBondContact O-N 3.07Å; D577-K580 IonicContact OD1-NZ 2.67Å; D577-K580 PolarHBondContact OD1-NZ 3.17Å; K580-N583 PolarHBondContact O-N 2.94Å; K580-M584 WeakPolarHBondContact O-CG 3.5Å; K580-M584 PolarHBondContact O-N 3.4Å
581	Q	75.8	Confident	71	Confident	108 Å²	108	98.2 Å²	98.2	51%	0.505	50%	0.498	S	S	.	.	H	α-helix	trans	-63.1	-47.8	179.7	-170.8	171.2	-6.4	0	0	111.2	D577 T578 N583 M584 E585	D577-Q581 WeakPolarHBondContact O-CB 3.5Å; D577-Q581 PolarHBondContact O-N 3.26Å; T578-Q581 PolarHBondContact O-N 3.11Å; Q581-N583 VanDerWaalsContact C-N 3.3Å; Q581-N583 PolarHBondContact O-N 3.15Å; Q581-M584 PolarHBondContact O-N 2.98Å; Q581-M584 VanDerWaalsContact O-N 3.1Å; Q581-E585 WeakPolarHBondContact O-CG 3.5Å; Q581-E585 PolarHBondContact O-N 2.61Å
582	L	73.1	Confident	69.7	Low	98 Å²	98	97.1 Å²	97.1	51%	0.513	50%	0.5	S	S	.	.	H	α-helix	trans	-57.7	-40.1	172.3	-73.4	170.3	0	0	0	112.2	T578 E585 N586	T578-L582 HydrophobicContact CG2-CD1 4.28Å; T578-L582 WeakPolarHBondContact O-CB 3.21Å; T578-L582 WeakPolarHBondContact O-CG 3.29Å; T578-L582 PolarHBondContact O-N 3.08Å; L582-E585 PolarHBondContact O-N 3.18Å; L582-N586 VanDerWaalsContact O-CB 3.3Å; L582-N586 WeakPolarHBondContact O-CB 3.32Å; L582-N586 PolarHBondContact O-N 3.13Å
583	N	74	Confident	68.4	Low	92 Å²	92	98.1 Å²	98.1	49%	0.492	50%	0.502	S	S	.	.	H	α-helix	trans	-66.6	-35.3	175.6	-78.3	-15.5	0	0	0	113	I579 K580 Q581 N587	I579-N583 WeakPolarHBondContact O-CB 3.48Å; I579-N583 PolarHBondContact O-N 3.28Å; K580-N583 PolarHBondContact O-N 2.94Å; Q581-N583 VanDerWaalsContact C-N 3.3Å; Q581-N583 PolarHBondContact O-N 3.15Å; N583-N587 WeakPolarHBondContact O-CB 3.46Å; N583-N587 PolarHBondContact O-N 3.33Å; N583-N587 PolarHBondContact O-ND2 2.92Å
584	M	73.5	Confident	66.8	Low	112 Å²	112	102 Å²	102	55%	0.552	52%	0.518	S	S	*	.	H	α-helix	trans	-68.4	-43.2	174.1	-69.1	-173.6	-62.1	0	0	111.5	K580 Q581 N587 Q588	K580-M584 WeakPolarHBondContact O-CG 3.5Å; K580-M584 PolarHBondContact O-N 3.4Å; Q581-M584 PolarHBondContact O-N 2.98Å; Q581-M584 VanDerWaalsContact O-N 3.1Å; M584-N587 PolarHBondContact O-N 3.29Å; M584-Q588 WeakPolarHBondContact O-CG 3.46Å; M584-Q588 PolarHBondContact O-N 3.06Å
585	E	71.1	Confident	65.3	Low	84 Å²	84	100.3 Å²	100.3	39%	0.393	52%	0.524	S	S	.	.	H	α-helix	trans	-61.6	-44.8	174	-71.5	168.1	-168.6	0	0	111	Q581 L582 N587 Q588 I589	Q581-E585 WeakPolarHBondContact O-CG 3.5Å; Q581-E585 PolarHBondContact O-N 2.61Å; L582-E585 PolarHBondContact O-N 3.18Å; E585-N587 VanDerWaalsContact C-N 3.33Å; E585-N587 PolarHBondContact O-N 3.25Å; E585-Q588 PolarHBondContact O-N 3.3Å; E585-I589 WeakPolarHBondContact O-CB 3.43Å; E585-I589 VanDerWaalsContact O-CG1 3.25Å; E585-I589 WeakPolarHBondContact O-CG1 3.44Å; E585-I589 PolarHBondContact O-N 3.18Å
586	N	67.4	Low	63.5	Low	96 Å²	96	102.9 Å²	102.9	51%	0.513	53%	0.533	S	S	.	.	H	α-helix	trans	-63	-39.2	177.4	-137.1	8.9	0	0	0	111.6	L582 I589 T590	L582-N586 VanDerWaalsContact O-CB 3.3Å; L582-N586 WeakPolarHBondContact O-CB 3.32Å; L582-N586 PolarHBondContact O-N 3.13Å; N586-I589 PolarHBondContact O-N 3.03Å; N586-T590 PolarHBondContact O-N 2.67Å; N586-T590 PolarHBondContact O-OG1 2.98Å; N586-T590 VanDerWaalsContact O-OG1 3.13Å
587	N	64.2	Low	61.7	Low	106 Å²	106	104.6 Å²	104.6	57%	0.567	55%	0.546	S	S	*	.	H	α-helix	trans	-62.9	-43	174.7	-75.4	-12.1	0	0	0	111.7	N583 M584 E585 T590 T591	N583-N587 WeakPolarHBondContact O-CB 3.46Å; N583-N587 PolarHBondContact O-N 3.33Å; N583-N587 PolarHBondContact O-ND2 2.92Å; M584-N587 PolarHBondContact O-N 3.29Å; E585-N587 VanDerWaalsContact C-N 3.33Å; E585-N587 PolarHBondContact O-N 3.25Å; N587-T590 WeakPolarHBondContact CA-OG1 3.48Å; N587-T590 PolarHBondContact O-N 3.28Å; N587-T590 PolarHBondContact O-OG1 3.05Å; N587-T591 PolarHBondContact O-N 3.09Å; N587-T591 PolarHBondContact O-OG1 3.04Å
588	Q	59.6	Low	59.8	Low	128 Å²	128	107.6 Å²	107.6	60%	0.598	56%	0.562	S	S	*	*	H	α-helix	trans	-63.7	-40	173.9	-70	175.5	8.8	0	0	112.2	M584 E585 T590 T591 V592	M584-Q588 WeakPolarHBondContact O-CG 3.46Å; M584-Q588 PolarHBondContact O-N 3.06Å; E585-Q588 PolarHBondContact O-N 3.3Å; Q588-T590 VanDerWaalsContact C-N 3.34Å; Q588-T590 PolarHBondContact O-N 2.98Å; Q588-T591 PolarHBondContact O-N 3.3Å; Q588-T591 PolarHBondContact O-OG1 2.83Å; Q588-V592 WeakPolarHBondContact O-CG2 3.46Å; Q588-V592 PolarHBondContact O-N 3.04Å
589	I	56	Low	58.1	Low	86 Å²	86	110.7 Å²	110.7	44%	0.441	58%	0.58	S	S	.	*	H	α-helix	trans	-64.2	-39.4	175.4	-69.9	165.6	0	0	0	110.5	E585 N586 V592 H593	E585-I589 WeakPolarHBondContact O-CB 3.43Å; E585-I589 VanDerWaalsContact O-CG1 3.25Å; E585-I589 WeakPolarHBondContact O-CG1 3.44Å; E585-I589 PolarHBondContact O-N 3.18Å; N586-I589 PolarHBondContact O-N 3.03Å; I589-V592 PolarHBondContact O-N 3.2Å; I589-H593 PolarHBondContact O-CD2 3.2Å; I589-H593 PolarHBondContact O-N 3.36Å
590	T	51.7	Low	56.7	Low	70 Å²	70	112.1 Å²	112.1	43%	0.429	60%	0.598	S	S	.	*	H	α-helix	trans	-71.4	-24.8	175.1	49.2	0	0	0	0	114.8	N586 N587 Q588 Q594	N586-T590 PolarHBondContact O-N 2.67Å; N586-T590 PolarHBondContact O-OG1 2.98Å; N586-T590 VanDerWaalsContact O-OG1 3.13Å; N587-T590 WeakPolarHBondContact CA-OG1 3.48Å; N587-T590 PolarHBondContact O-N 3.28Å; N587-T590 PolarHBondContact O-OG1 3.05Å; Q588-T590 VanDerWaalsContact C-N 3.34Å; Q588-T590 PolarHBondContact O-N 2.98Å; T590-Q594 VanDerWaalsContact O-CG 3.29Å; T590-Q594 WeakPolarHBondContact O-CG 3.44Å; T590-Q594 PolarHBondContact O-NE2 2.95Å; T590-Q594 VanDerWaalsContact O-NE2 3.17Å
591	T	51.4	Low	55.4	Low	97 Å²	97	111.2 Å²	111.2	60%	0.595	61%	0.605	S	S	*	*	H	α-helix	trans	-81.5	-29.9	172.3	51.5	0	0	0	0	112.3	N587 Q588	N587-T591 PolarHBondContact O-N 3.09Å; N587-T591 PolarHBondContact O-OG1 3.04Å; Q588-T591 PolarHBondContact O-N 3.3Å; Q588-T591 PolarHBondContact O-OG1 2.83Å
592	V	51.4	Low	54.3	Low	98 Å²	98	111.6 Å²	111.6	59%	0.594	62%	0.615	S	S	*	*	H	α-helix	trans	-74.2	-37	174	172.8	0	0	0	0	112.3	Q588 I589 Q594 S595	Q588-V592 WeakPolarHBondContact O-CG2 3.46Å; Q588-V592 PolarHBondContact O-N 3.04Å; I589-V592 PolarHBondContact O-N 3.2Å; V592-Q594 VanDerWaalsContact C-N 3.33Å; V592-Q594 PolarHBondContact O-N 3.45Å; V592-S595 PolarHBondContact O-OG 3.44Å
593	H	48.9	Very low	53.2	Low	120 Å²	120	112.6 Å²	112.6	56%	0.556	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.5	5.9	179.7	-73.9	-54.4	0	0	0	115.7	I589 S595	I589-H593 PolarHBondContact O-CD2 3.2Å; I589-H593 PolarHBondContact O-N 3.36Å; H593-S595 VanDerWaalsContact C-N 3.29Å
594	Q	46.4	Very low	52.2	Low	161 Å²	161	114 Å²	114	75%	0.752	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.1	-3.1	172.7	-81.9	173.3	33	0	0	113.9	T590 V592	T590-Q594 VanDerWaalsContact O-CG 3.29Å; T590-Q594 WeakPolarHBondContact O-CG 3.44Å; T590-Q594 PolarHBondContact O-NE2 2.95Å; T590-Q594 VanDerWaalsContact O-NE2 3.17Å; V592-Q594 VanDerWaalsContact C-N 3.33Å; V592-Q594 PolarHBondContact O-N 3.45Å
595	S	45	Very low	51.2	Low	102 Å²	102	112.1 Å²	112.1	71%	0.713	62%	0.62	S	S	*	*	S	Bend	trans	-105.7	-5.8	177.1	53.9	0	0	0	0	115.2	V592 H593	V592-S595 PolarHBondContact O-OG 3.44Å; H593-S595 VanDerWaalsContact C-N 3.29Å
596	E	40.4	Very low	50.5	Low	155 Å²	155	114 Å²	114	72%	0.724	63%	0.631	S	S	*	*			trans	-115	100.4	179.7	-71.9	-169.4	154.3	0	0	112.3
597	N	38.4	Very low	50.3	Low	148 Å²	148	114.2 Å²	114.2	79%	0.791	63%	0.631	S	S	*	*			trans	-81.6	141.4	179.8	-104.6	-28.6	0	0	0	112.6
598	N	39.3	Very low	50.3	Low	132 Å²	132	111.7 Å²	111.7	71%	0.706	62%	0.622	S	S	*	*			trans	89.1	126.5	147.9	-58.7	-27.1	0	0	0	121.7
599	T	41.3	Very low	50.7	Low	140 Å²	140	111.9 Å²	111.9	86%	0.859	62%	0.621	S	S	*	*	S	Bend	trans	71.6	78.5	146.7	52.6	0	0	0	0	120.4
600	S	44.8	Very low	51.6	Low	115 Å²	115	113.7 Å²	113.7	80%	0.804	63%	0.625	S	S	*	*	S	Bend	trans	-167.9	-26.8	145.6	-161.3	0	0	0	0	115.1	T602	S600-T602 PolarHBondContact O-N 3.16Å; S600-T602 VanDerWaalsContact O-N 3.17Å
601	S	50.4	Low	52.5	Low	88 Å²	88	117 Å²	117	62%	0.615	63%	0.634	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.6	10.8	-150.2	59.2	0	0	0	0	119.5	N605	S601-N605 WeakPolarHBondContact O-CB 3.49Å
602	T	52.5	Low	53.5	Low	115 Å²	115	117.6 Å²	117.6	71%	0.706	63%	0.633	S	S	*	*	H	α-helix	trans	-74.4	-29.7	-170.2	10.5	0	0	0	0	115.5	S600	S600-T602 PolarHBondContact O-N 3.16Å; S600-T602 VanDerWaalsContact O-N 3.17Å
603	L	49.2	Very low	54.8	Low	120 Å²	120	119.5 Å²	119.5	63%	0.628	63%	0.633	S	S	*	*	H	α-helix	trans	-82.7	-47.8	-174.6	-151.4	76.3	0	0	0	112.4	N605 M606 N607	L603-N605 VanDerWaalsContact C-N 3.27Å; L603-N605 PolarHBondContact O-N 3.47Å; L603-M606 PolarHBondContact O-N 3.46Å; L603-N607 PolarHBondContact O-N 2.93Å; L603-N607 VanDerWaalsContact O-N 3.15Å
604	D	52.6	Low	56.1	Low	121 Å²	121	118.6 Å²	118.6	65%	0.647	63%	0.629	S	S	*	*	H	α-helix	trans	-65.7	-31.1	179	-65.8	-38	0	0	0	112.4	M606 N607 S608	D604-M606 VanDerWaalsContact C-N 3.3Å; D604-M606 PolarHBondContact O-N 2.88Å; D604-N607 PolarHBondContact O-N 2.94Å; D604-S608 WeakPolarHBondContact O-CB 3.06Å; D604-S608 PolarHBondContact O-N 3.28Å; D604-S608 PolarHBondContact O-OG 3.43Å
605	N	53.4	Low	57.5	Low	73 Å²	73	116.6 Å²	116.6	39%	0.39	62%	0.618	S	S	.	*	H	α-helix	trans	-69.6	-24.7	174.1	-162.6	-23.6	0	0	0	112.5	S601 L603 S608 K609	S601-N605 WeakPolarHBondContact O-CB 3.49Å; L603-N605 VanDerWaalsContact C-N 3.27Å; L603-N605 PolarHBondContact O-N 3.47Å; N605-S608 WeakPolarHBondContact CA-OG 3.49Å; N605-S608 PolarHBondContact O-OG 2.72Å; N605-K609 WeakPolarHBondContact O-CB 3.36Å; N605-K609 WeakPolarHBondContact O-CD 3.47Å; N605-K609 VanDerWaalsContact O-CG 3.23Å; N605-K609 WeakPolarHBondContact O-CG 3.49Å; N605-K609 PolarHBondContact O-N 3.33Å; N605-K609 WeakPolarHBondContact OD1-CE 3.35Å; N605-K609 PolarHBondContact OD1-NZ 3.48Å
606	M	57.1	Low	59.1	Low	124 Å²	124	114.3 Å²	114.3	61%	0.611	60%	0.602	S	S	*	*	H	α-helix	trans	-79	-39	170.3	-74.1	-157.1	-73.9	0	0	112.2	L603 D604 K610	L603-M606 PolarHBondContact O-N 3.46Å; D604-M606 VanDerWaalsContact C-N 3.3Å; D604-M606 PolarHBondContact O-N 2.88Å; M606-K610 WeakPolarHBondContact O-CB 3.18Å; M606-K610 PolarHBondContact O-N 3.25Å
607	N	63	Low	61.1	Low	99 Å²	99	110.8 Å²	110.8	53%	0.529	59%	0.588	S	S	.	*	H	α-helix	trans	-65.1	-43.9	175.5	-75.6	-24.7	0	0	0	112.1	L603 D604 K610 F611	L603-N607 PolarHBondContact O-N 2.93Å; L603-N607 VanDerWaalsContact O-N 3.15Å; D604-N607 PolarHBondContact O-N 2.94Å; N607-K610 PolarHBondContact O-N 2.98Å; N607-F611 PolarHBondContact O-N 2.98Å
608	S	63	Low	63.2	Low	53 Å²	53	107.5 Å²	107.5	37%	0.371	57%	0.571	S	S	.	*	H	α-helix	trans	-64.5	-42.4	177	66	0	0	0	0	112.1	D604 N605 K610 F611 I612	D604-S608 WeakPolarHBondContact O-CB 3.06Å; D604-S608 PolarHBondContact O-N 3.28Å; D604-S608 PolarHBondContact O-OG 3.43Å; N605-S608 WeakPolarHBondContact CA-OG 3.49Å; N605-S608 PolarHBondContact O-OG 2.72Å; S608-K610 VanDerWaalsContact C-N 3.35Å; S608-K610 PolarHBondContact O-N 3.04Å; S608-F611 PolarHBondContact O-N 2.85Å; S608-I612 WeakPolarHBondContact O-CB 3.33Å; S608-I612 VanDerWaalsContact O-CG1 3.22Å; S608-I612 WeakPolarHBondContact O-CG1 3.47Å; S608-I612 PolarHBondContact O-N 3.44Å
609	K	68.9	Low	65.2	Low	132 Å²	132	104.5 Å²	104.5	57%	0.574	55%	0.554	S	S	*	*	H	α-helix	trans	-61.7	-38.8	173.4	-78.4	173.6	-179.9	165.4	0	113	N605 K613	N605-K609 WeakPolarHBondContact O-CB 3.36Å; N605-K609 WeakPolarHBondContact O-CD 3.47Å; N605-K609 VanDerWaalsContact O-CG 3.23Å; N605-K609 WeakPolarHBondContact O-CG 3.49Å; N605-K609 PolarHBondContact O-N 3.33Å; N605-K609 WeakPolarHBondContact OD1-CE 3.35Å; N605-K609 PolarHBondContact OD1-NZ 3.48Å; K609-K613 WeakPolarHBondContact O-CB 3.49Å; K609-K613 PolarHBondContact O-N 2.98Å
610	K	74.9	Confident	67.2	Low	124 Å²	124	102.3 Å²	102.3	54%	0.539	54%	0.536	S	S	.	.	H	α-helix	trans	-64.7	-47	175.3	-167.3	-179.5	-175.1	-96.6	0	111.1	M606 N607 S608 K613 E614	M606-K610 WeakPolarHBondContact O-CB 3.18Å; M606-K610 PolarHBondContact O-N 3.25Å; N607-K610 PolarHBondContact O-N 2.98Å; S608-K610 VanDerWaalsContact C-N 3.35Å; S608-K610 PolarHBondContact O-N 3.04Å; K610-K613 PolarHBondContact O-N 3.49Å; K610-E614 WeakPolarHBondContact CE-OE1 3.49Å; K610-E614 IonicContact NZ-OE1 3.92Å; K610-E614 PolarHBondContact NZ-OE1 2.94Å; K610-E614 WeakPolarHBondContact O-CG 3.42Å; K610-E614 PolarHBondContact O-N 3.4Å
611	F	70.4	Confident	69.1	Low	140 Å²	140	102.1 Å²	102.1	61%	0.614	52%	0.522	S	S	*	.	H	α-helix	trans	-63	-44.7	178.2	-175	-95.8	0	0	0	112.5	N607 S608 K613 E614 F615	N607-F611 PolarHBondContact O-N 2.98Å; S608-F611 PolarHBondContact O-N 2.85Å; F611-K613 VanDerWaalsContact C-N 3.28Å; F611-K613 PolarHBondContact O-N 3.46Å; F611-E614 PolarHBondContact O-N 2.95Å; F611-F615 VanDerWaalsContact O-CB 3.27Å; F611-F615 WeakPolarHBondContact O-CB 3.4Å; F611-F615 PolarHBondContact O-N 3.49Å
612	I	72.2	Confident	70.7	Confident	109 Å²	109	102.8 Å²	102.8	56%	0.559	52%	0.515	S	S	*	.	H	α-helix	trans	-60.7	-39.1	175.4	-69.7	165.9	0	0	0	110.8	S608 S616	S608-I612 WeakPolarHBondContact O-CB 3.33Å; S608-I612 VanDerWaalsContact O-CG1 3.22Å; S608-I612 WeakPolarHBondContact O-CG1 3.47Å; S608-I612 PolarHBondContact O-N 3.44Å; I612-S616 WeakPolarHBondContact O-CB 3.47Å; I612-S616 PolarHBondContact O-N 3.02Å
613	K	77.7	Confident	72.2	Confident	138 Å²	138	102.1 Å²	102.1	60%	0.6	51%	0.507	S	S	*	.	H	α-helix	trans	-66.7	-49.4	176.1	-172.2	-179.2	176.5	-173	0	111.8	K609 K610 F611 F615 S616 D617	K609-K613 WeakPolarHBondContact O-CB 3.49Å; K609-K613 PolarHBondContact O-N 2.98Å; K610-K613 PolarHBondContact O-N 3.49Å; F611-K613 VanDerWaalsContact C-N 3.28Å; F611-K613 PolarHBondContact O-N 3.46Å; K613-F615 VanDerWaalsContact C-N 3.31Å; K613-F615 PolarHBondContact O-N 3.28Å; K613-S616 PolarHBondContact O-N 3.03Å; K613-D617 WeakPolarHBondContact CE-OD2 3.47Å; K613-D617 WeakPolarHBondContact O-CB 3.32Å; K613-D617 VanDerWaalsContact O-CG 3.31Å; K613-D617 PolarHBondContact O-N 3.43Å
614	E	77.3	Confident	74	Confident	101 Å²	101	101.3 Å²	101.3	47%	0.472	50%	0.5	S	S	.	.	H	α-helix	trans	-59.1	-42.1	177.8	-73.8	173	-177.9	0	0	111.7	K610 F611 D617 D618	K610-E614 WeakPolarHBondContact CE-OE1 3.49Å; K610-E614 IonicContact NZ-OE1 3.92Å; K610-E614 PolarHBondContact NZ-OE1 2.94Å; K610-E614 WeakPolarHBondContact O-CG 3.42Å; K610-E614 PolarHBondContact O-N 3.4Å; F611-E614 PolarHBondContact O-N 2.95Å; E614-D617 PolarHBondContact O-N 3.28Å; E614-D618 WeakPolarHBondContact O-CB 3.29Å; E614-D618 PolarHBondContact O-N 2.89Å
615	F	75.9	Confident	75.6	Confident	120 Å²	120	99.3 Å²	99.3	53%	0.526	49%	0.487	S	S	.	.	H	α-helix	trans	-66.9	-38.9	175.4	-174.5	-109.5	0	0	0	112.8	F611 K613 I619	F611-F615 VanDerWaalsContact O-CB 3.27Å; F611-F615 WeakPolarHBondContact O-CB 3.4Å; F611-F615 PolarHBondContact O-N 3.49Å; K613-F615 VanDerWaalsContact C-N 3.31Å; K613-F615 PolarHBondContact O-N 3.28Å; F615-I619 HydrophobicContact CD1-CD1 3.83Å; F615-I619 HydrophobicContact CE1-CD1 3.38Å; F615-I619 HydrophobicContact CE1-CG1 4.5Å; F615-I619 HydrophobicContact CE2-CD1 4.27Å; F615-I619 HydrophobicContact CG-CD1 4.45Å; F615-I619 HydrophobicContact CZ-CD1 3.64Å; F615-I619 HydrophobicContact CZ-CG1 4.5Å; F615-I619 WeakPolarHBondContact O-CB 3.41Å; F615-I619 WeakPolarHBondContact O-CG1 3.26Å; F615-I619 PolarHBondContact O-N 3.4Å
616	S	78	Confident	77.1	Confident	54 Å²	54	97.8 Å²	97.8	38%	0.378	48%	0.484	S	S	.	.	H	α-helix	trans	-66	-42.6	174.1	-175.7	0	0	0	0	111.8	I612 K613 I619 I620	I612-S616 WeakPolarHBondContact O-CB 3.47Å; I612-S616 PolarHBondContact O-N 3.02Å; K613-S616 PolarHBondContact O-N 3.03Å; S616-I619 PolarHBondContact O-N 3.22Å; S616-I620 WeakPolarHBondContact O-CB 3.29Å; S616-I620 WeakPolarHBondContact O-CD1 3.4Å; S616-I620 WeakPolarHBondContact O-CG1 3.45Å; S616-I620 PolarHBondContact O-N 3.36Å
617	D	82.5	Confident	78.5	Confident	81 Å²	81	96.6 Å²	96.6	43%	0.433	48%	0.479	S	S	.	.	H	α-helix	trans	-66.6	-38.9	179.7	-71.5	-20.5	0	0	0	110.8	K613 E614 I620 H621	K613-D617 WeakPolarHBondContact CE-OD2 3.47Å; K613-D617 WeakPolarHBondContact O-CB 3.32Å; K613-D617 VanDerWaalsContact O-CG 3.31Å; K613-D617 PolarHBondContact O-N 3.43Å; E614-D617 PolarHBondContact O-N 3.28Å; D617-I620 PolarHBondContact O-N 2.94Å; D617-H621 WeakPolarHBondContact O-CB 3.49Å; D617-H621 PolarHBondContact O-N 3.37Å
618	D	83.2	Confident	79.7	Confident	79 Å²	79	95.2 Å²	95.2	42%	0.422	47%	0.472	S	S	.	.	H	α-helix	trans	-66.2	-44.6	172.8	-177	36	0	0	0	112.4	E614 I620 H621 Q622	E614-D618 WeakPolarHBondContact O-CB 3.29Å; E614-D618 PolarHBondContact O-N 2.89Å; D618-I620 VanDerWaalsContact C-N 3.33Å; D618-I620 PolarHBondContact O-N 2.99Å; D618-H621 WeakPolarHBondContact O-CB 3.12Å; D618-H621 PolarHBondContact O-N 3.24Å; D618-Q622 WeakPolarHBondContact O-CG 3.46Å; D618-Q622 PolarHBondContact O-N 3.46Å; D618-Q622 PolarHBondContact OD1-NE2 2.91Å; D618-Q622 PolarHBondContact OD2-NE2 2.87Å
619	I	81.8	Confident	80.9	Confident	68 Å²	68	98.9 Å²	98.9	35%	0.349	48%	0.478	S	S	.	.	H	α-helix	trans	-59.5	-43.3	173.3	-74.8	174.8	0	0	0	111.3	F615 S616 H621 Q622 L623	F615-I619 HydrophobicContact CD1-CD1 3.83Å; F615-I619 HydrophobicContact CE1-CD1 3.38Å; F615-I619 HydrophobicContact CE1-CG1 4.5Å; F615-I619 HydrophobicContact CE2-CD1 4.27Å; F615-I619 HydrophobicContact CG-CD1 4.45Å; F615-I619 HydrophobicContact CZ-CD1 3.64Å; F615-I619 HydrophobicContact CZ-CG1 4.5Å; F615-I619 WeakPolarHBondContact O-CB 3.41Å; F615-I619 WeakPolarHBondContact O-CG1 3.26Å; F615-I619 PolarHBondContact O-N 3.4Å; S616-I619 PolarHBondContact O-N 3.22Å; I619-H621 VanDerWaalsContact C-N 3.34Å; I619-H621 PolarHBondContact O-N 3.4Å; I619-Q622 PolarHBondContact O-N 3.37Å; I619-L623 HydrophobicContact CG2-CD1 3.8Å; I619-L623 HydrophobicContact CG2-CG 4.35Å; I619-L623 WeakPolarHBondContact O-CB 3.41Å; I619-L623 VanDerWaalsContact O-CG 3.27Å; I619-L623 WeakPolarHBondContact O-CG 3.19Å; I619-L623 PolarHBondContact O-N 2.95Å
620	I	83.4	Confident	81.8	Confident	95 Å²	95	98.5 Å²	98.5	49%	0.487	48%	0.476	S	S	.	.	H	α-helix	trans	-62	-43	176.5	-72.1	164.2	0	0	0	110.3	S616 D617 D618 L623 Q624	S616-I620 WeakPolarHBondContact O-CB 3.29Å; S616-I620 WeakPolarHBondContact O-CD1 3.4Å; S616-I620 WeakPolarHBondContact O-CG1 3.45Å; S616-I620 PolarHBondContact O-N 3.36Å; D617-I620 PolarHBondContact O-N 2.94Å; D618-I620 VanDerWaalsContact C-N 3.33Å; D618-I620 PolarHBondContact O-N 2.99Å; I620-L623 PolarHBondContact O-N 3.36Å; I620-Q624 VanDerWaalsContact O-CB 3.3Å; I620-Q624 WeakPolarHBondContact O-CB 3.36Å; I620-Q624 PolarHBondContact O-N 2.94Å
621	H	84.5	Confident	82.4	Confident	110 Å²	110	100.8 Å²	100.8	51%	0.509	48%	0.481	S	S	.	.	H	α-helix	trans	-61.9	-49.2	176.5	-172	-88.7	0	0	0	112	D617 D618 I619 L623 Q624 E625	D617-H621 WeakPolarHBondContact O-CB 3.49Å; D617-H621 PolarHBondContact O-N 3.37Å; D618-H621 WeakPolarHBondContact O-CB 3.12Å; D618-H621 PolarHBondContact O-N 3.24Å; I619-H621 VanDerWaalsContact C-N 3.34Å; I619-H621 PolarHBondContact O-N 3.4Å; H621-L623 VanDerWaalsContact C-N 3.34Å; H621-L623 PolarHBondContact O-N 3.27Å; H621-Q624 PolarHBondContact O-N 2.81Å; H621-E625 IonicContact CE1-OE1 3.2Å; H621-E625 PolarHBondContact CE1-OE1 3.46Å; H621-E625 PolarHBondContact O-N 3.23Å
622	Q	84.2	Confident	83.3	Confident	102 Å²	102	99 Å²	99	48%	0.477	48%	0.477	S	S	.	.	H	α-helix	trans	-62.1	-39.3	178.5	-68.8	178.4	32.6	0	0	112.6	D618 I619 A626	D618-Q622 WeakPolarHBondContact O-CG 3.46Å; D618-Q622 PolarHBondContact O-N 3.46Å; D618-Q622 PolarHBondContact OD1-NE2 2.91Å; D618-Q622 PolarHBondContact OD2-NE2 2.87Å; I619-Q622 PolarHBondContact O-N 3.37Å; Q622-A626 WeakPolarHBondContact O-CB 3.49Å; Q622-A626 PolarHBondContact O-N 3.49Å
623	L	84	Confident	84	Confident	102 Å²	102	98 Å²	98	53%	0.534	47%	0.47	S	S	.	.	H	α-helix	trans	-65.1	-43.6	173.1	-74.9	171.4	0	0	0	111.7	I619 I620 H621 E625 A626 I627	I619-L623 HydrophobicContact CG2-CD1 3.8Å; I619-L623 HydrophobicContact CG2-CG 4.35Å; I619-L623 WeakPolarHBondContact O-CB 3.41Å; I619-L623 VanDerWaalsContact O-CG 3.27Å; I619-L623 WeakPolarHBondContact O-CG 3.19Å; I619-L623 PolarHBondContact O-N 2.95Å; I620-L623 PolarHBondContact O-N 3.36Å; H621-L623 VanDerWaalsContact C-N 3.34Å; H621-L623 PolarHBondContact O-N 3.27Å; L623-E625 PolarHBondContact O-N 2.8Å; L623-A626 PolarHBondContact O-N 2.88Å; L623-I627 VanDerWaalsContact O-CG1 3.29Å; L623-I627 WeakPolarHBondContact O-CG1 3.42Å; L623-I627 PolarHBondContact O-N 3.04Å
624	Q	85.6	Confident	84.4	Confident	103 Å²	103	97.2 Å²	97.2	48%	0.481	47%	0.469	S	S	.	.	H	α-helix	trans	-64.4	-40.7	178.9	-170.3	66.8	0.6	0	0	111.7	I620 H621 I627 N628	I620-Q624 VanDerWaalsContact O-CB 3.3Å; I620-Q624 WeakPolarHBondContact O-CB 3.36Å; I620-Q624 PolarHBondContact O-N 2.94Å; H621-Q624 PolarHBondContact O-N 2.81Å; Q624-I627 PolarHBondContact O-N 3.28Å; Q624-N628 WeakPolarHBondContact O-CB 3.46Å; Q624-N628 VanDerWaalsContact O-CG 3.3Å; Q624-N628 PolarHBondContact O-N 2.88Å; Q624-N628 PolarHBondContact O-ND2 3.43Å
625	E	86.6	Confident	85	Confident	78 Å²	78	96.3 Å²	96.3	36%	0.364	47%	0.466	S	S	.	.	H	α-helix	trans	-62.3	-43.6	170.7	-72.2	-162.8	162	0	0	112.5	H621 L623 I627 N628 R629	H621-E625 IonicContact CE1-OE1 3.2Å; H621-E625 PolarHBondContact CE1-OE1 3.46Å; H621-E625 PolarHBondContact O-N 3.23Å; L623-E625 PolarHBondContact O-N 2.8Å; E625-I627 VanDerWaalsContact C-N 3.32Å; E625-I627 PolarHBondContact O-N 3.11Å; E625-N628 PolarHBondContact O-N 3.2Å; E625-R629 VanDerWaalsContact CB-NH2 3.25Å; E625-R629 WeakPolarHBondContact O-CB 3.47Å; E625-R629 WeakPolarHBondContact O-CG 3.31Å; E625-R629 PolarHBondContact O-N 3.29Å; E625-R629 IonicContact OE2-CZ 3.1Å; E625-R629 VanDerWaalsContact OE2-CZ 3.25Å; E625-R629 IonicContact OE2-NH1 3.95Å; E625-R629 PolarHBondContact OE2-NH1 2.59Å; E625-R629 IonicContact OE2-NH2 2.87Å; E625-R629 PolarHBondContact OE2-NH2 2.87Å
626	A	84.4	Confident	85.6	Confident	41 Å²	41	95.2 Å²	95.2	34%	0.339	47%	0.465	S	S	.	.	H	α-helix	trans	-62.4	-40.3	178.6	0	0	0	0	0	111.8	Q622 L623 K630	Q622-A626 WeakPolarHBondContact O-CB 3.49Å; Q622-A626 PolarHBondContact O-N 3.49Å; L623-A626 PolarHBondContact O-N 2.88Å; A626-K630 WeakPolarHBondContact O-CB 3.39Å; A626-K630 WeakPolarHBondContact O-CG 3.37Å; A626-K630 PolarHBondContact O-N 2.88Å
627	I	86.6	Confident	86	Confident	99 Å²	99	97.7 Å²	97.7	51%	0.508	47%	0.472	S	S	.	.	H	α-helix	trans	-62.6	-46.2	172.8	-70.1	165.3	0	0	0	110.6	L623 Q624 E625 K630 R631	L623-I627 VanDerWaalsContact O-CG1 3.29Å; L623-I627 WeakPolarHBondContact O-CG1 3.42Å; L623-I627 PolarHBondContact O-N 3.04Å; Q624-I627 PolarHBondContact O-N 3.28Å; E625-I627 VanDerWaalsContact C-N 3.32Å; E625-I627 PolarHBondContact O-N 3.11Å; I627-K630 PolarHBondContact O-N 2.82Å; I627-R631 WeakPolarHBondContact O-CB 3.28Å; I627-R631 PolarHBondContact O-N 3.02Å
628	N	88	Confident	86.3	Confident	71 Å²	71	99.8 Å²	99.8	38%	0.38	48%	0.478	S	S	.	.	H	α-helix	trans	-62.8	-44.6	178	-76.6	-26.2	0	0	0	112.3	Q624 E625 K630 R631 I632	Q624-N628 WeakPolarHBondContact O-CB 3.46Å; Q624-N628 VanDerWaalsContact O-CG 3.3Å; Q624-N628 PolarHBondContact O-N 2.88Å; Q624-N628 PolarHBondContact O-ND2 3.43Å; E625-N628 PolarHBondContact O-N 3.2Å; N628-K630 VanDerWaalsContact C-N 3.35Å; N628-K630 PolarHBondContact O-N 3.38Å; N628-R631 WeakPolarHBondContact O-CB 3.28Å; N628-R631 PolarHBondContact O-N 2.87Å; N628-I632 WeakPolarHBondContact O-CG1 3.22Å; N628-I632 PolarHBondContact O-N 3.01Å
629	R	87.9	Confident	86.6	Confident	130 Å²	130	100.1 Å²	100.1	49%	0.491	48%	0.479	S	S	.	.	H	α-helix	trans	-56.5	-47.2	172.9	-75.1	-175.5	-81.7	-100.1	0.8	111.2	E625 R631 I632 E633	E625-R629 VanDerWaalsContact CB-NH2 3.25Å; E625-R629 WeakPolarHBondContact O-CB 3.47Å; E625-R629 WeakPolarHBondContact O-CG 3.31Å; E625-R629 PolarHBondContact O-N 3.29Å; E625-R629 IonicContact OE2-CZ 3.1Å; E625-R629 VanDerWaalsContact OE2-CZ 3.25Å; E625-R629 IonicContact OE2-NH1 3.95Å; E625-R629 PolarHBondContact OE2-NH1 2.59Å; E625-R629 IonicContact OE2-NH2 2.87Å; E625-R629 PolarHBondContact OE2-NH2 2.87Å; R629-R631 PolarHBondContact O-N 3.44Å; R629-I632 PolarHBondContact O-N 2.9Å; R629-E633 PolarHBondContact O-N 3.07Å
630	K	88.2	Confident	87	Confident	124 Å²	124	104 Å²	104	54%	0.539	49%	0.494	S	S	.	.	H	α-helix	trans	-67	-32	177.1	-71.2	-70.6	166.8	-132.4	0	113.7	A626 I627 N628 E633 H634	A626-K630 WeakPolarHBondContact O-CB 3.39Å; A626-K630 WeakPolarHBondContact O-CG 3.37Å; A626-K630 PolarHBondContact O-N 2.88Å; I627-K630 PolarHBondContact O-N 2.82Å; N628-K630 VanDerWaalsContact C-N 3.35Å; N628-K630 PolarHBondContact O-N 3.38Å; K630-E633 WeakPolarHBondContact CD-OE2 3.4Å; K630-E633 IonicContact NZ-OE1 2.99Å; K630-E633 PolarHBondContact NZ-OE1 3.16Å; K630-E633 IonicContact NZ-OE2 2.59Å; K630-E633 PolarHBondContact NZ-OE2 3.38Å; K630-H634 WeakPolarHBondContact O-CB 3.47Å; K630-H634 PolarHBondContact O-N 3.08Å
631	R	87	Confident	87	Confident	171 Å²	171	103.8 Å²	103.8	65%	0.645	49%	0.493	S	S	*	.	H	α-helix	trans	-65.8	-41.7	174	-168.1	177	-175.3	176.9	1.6	111.6	I627 N628 R629 H634 I635	I627-R631 WeakPolarHBondContact O-CB 3.28Å; I627-R631 PolarHBondContact O-N 3.02Å; N628-R631 WeakPolarHBondContact O-CB 3.28Å; N628-R631 PolarHBondContact O-N 2.87Å; R629-R631 PolarHBondContact O-N 3.44Å; R631-H634 PolarHBondContact O-N 3.36Å; R631-I635 HydrophobicContact CG-CD1 4.37Å; R631-I635 WeakPolarHBondContact O-CG1 3.48Å; R631-I635 PolarHBondContact O-N 3.4Å
632	I	90	Very high	87.2	Confident	104 Å²	104	102 Å²	102	53%	0.533	49%	0.486	S	S	.	.	H	α-helix	trans	-65.7	-46.3	175.1	-65.4	166.4	0	0	0	110.7	N628 R629 H634 I635 N636	N628-I632 WeakPolarHBondContact O-CG1 3.22Å; N628-I632 PolarHBondContact O-N 3.01Å; R629-I632 PolarHBondContact O-N 2.9Å; I632-H634 VanDerWaalsContact C-N 3.28Å; I632-H634 PolarHBondContact O-N 2.94Å; I632-I635 PolarHBondContact O-N 3.4Å; I632-N636 PolarHBondContact O-N 3.19Å
633	E	86.7	Confident	87.3	Confident	86 Å²	86	101.1 Å²	101.1	40%	0.402	49%	0.488	S	S	.	.	H	α-helix	trans	-54.9	-44.1	173.3	-74.2	176.2	-149.1	0	0	111.9	R629 K630 N636 M637	R629-E633 PolarHBondContact O-N 3.07Å; K630-E633 WeakPolarHBondContact CD-OE2 3.4Å; K630-E633 IonicContact NZ-OE1 2.99Å; K630-E633 PolarHBondContact NZ-OE1 3.16Å; K630-E633 IonicContact NZ-OE2 2.59Å; K630-E633 PolarHBondContact NZ-OE2 3.38Å; E633-N636 PolarHBondContact O-N 2.71Å; E633-M637 HydrophobicContact CB-CE 4.5Å; E633-M637 WeakPolarHBondContact O-CG 3.45Å; E633-M637 PolarHBondContact O-N 2.92Å
634	H	86.1	Confident	87.4	Confident	123 Å²	123	100.6 Å²	100.6	57%	0.569	49%	0.485	S	S	*	.	H	α-helix	trans	-65.3	-40.3	178.5	-176	-98.5	0	0	0	113	K630 R631 I632 M637 K638	K630-H634 WeakPolarHBondContact O-CB 3.47Å; K630-H634 PolarHBondContact O-N 3.08Å; R631-H634 PolarHBondContact O-N 3.36Å; I632-H634 VanDerWaalsContact C-N 3.28Å; I632-H634 PolarHBondContact O-N 2.94Å; H634-M637 PolarHBondContact O-N 2.99Å; H634-K638 WeakPolarHBondContact O-CB 3.48Å; H634-K638 PolarHBondContact O-N 3.48Å
635	I	89.5	Confident	87.3	Confident	81 Å²	81	100.6 Å²	100.6	42%	0.415	49%	0.485	S	S	.	.	H	α-helix	trans	-63.2	-44.6	174.2	-69.4	164.4	0	0	0	110.5	R631 I632 M637 K638 N639	R631-I635 HydrophobicContact CG-CD1 4.37Å; R631-I635 WeakPolarHBondContact O-CG1 3.48Å; R631-I635 PolarHBondContact O-N 3.4Å; I632-I635 PolarHBondContact O-N 3.4Å; I635-M637 PolarHBondContact O-N 2.98Å; I635-K638 WeakPolarHBondContact O-CB 3.5Å; I635-K638 PolarHBondContact O-N 3.05Å; I635-N639 PolarHBondContact O-N 3.32Å
636	N	88.5	Confident	87.4	Confident	97 Å²	97	100.3 Å²	100.3	52%	0.519	49%	0.486	S	S	.	.	H	α-helix	trans	-63.3	-40.3	177.2	-73.9	-16.2	0	0	0	112.3	I632 E633 N639 K640	I632-N636 PolarHBondContact O-N 3.19Å; E633-N636 PolarHBondContact O-N 2.71Å; N636-N639 PolarHBondContact O-N 3.18Å; N636-K640 WeakPolarHBondContact O-CB 3.33Å; N636-K640 PolarHBondContact O-N 3.44Å
637	M	86.4	Confident	87.3	Confident	106 Å²	106	101.5 Å²	101.5	52%	0.522	49%	0.485	S	S	.	.	H	α-helix	trans	-63.8	-43.2	172.6	-74.1	-172.3	-71.1	0	0	112.1	E633 H634 I635 N639 K640 I641	E633-M637 HydrophobicContact CB-CE 4.5Å; E633-M637 WeakPolarHBondContact O-CG 3.45Å; E633-M637 PolarHBondContact O-N 2.92Å; H634-M637 PolarHBondContact O-N 2.99Å; I635-M637 PolarHBondContact O-N 2.98Å; M637-N639 PolarHBondContact O-N 2.64Å; M637-K640 PolarHBondContact O-N 2.77Å; M637-I641 WeakPolarHBondContact O-CG1 3.42Å; M637-I641 PolarHBondContact O-N 2.99Å
638	K	89.4	Confident	87	Confident	126 Å²	126	99.6 Å²	99.6	55%	0.548	48%	0.478	S	S	.	.	H	α-helix	trans	-59.7	-46.1	176.1	-174.3	-178.6	178.5	-175.9	0	111.7	H634 I635 K640 I641 I642	H634-K638 WeakPolarHBondContact O-CB 3.48Å; H634-K638 PolarHBondContact O-N 3.48Å; I635-K638 WeakPolarHBondContact O-CB 3.5Å; I635-K638 PolarHBondContact O-N 3.05Å; K638-K640 VanDerWaalsContact C-N 3.34Å; K638-K640 PolarHBondContact O-N 2.82Å; K638-I641 PolarHBondContact O-N 2.94Å; K638-I642 HydrophobicContact CG-CD1 4.21Å; K638-I642 WeakPolarHBondContact O-CG1 3.15Å; K638-I642 PolarHBondContact O-N 3.41Å
639	N	90.1	Very high	86.8	Confident	85 Å²	85	101.8 Å²	101.8	46%	0.455	48%	0.484	S	S	.	.	H	α-helix	trans	-62.4	-41.7	177.2	-69.2	-10.6	0	0	0	111.6	I635 N636 M637 I641 I642 T643	I635-N639 PolarHBondContact O-N 3.32Å; N636-N639 PolarHBondContact O-N 3.18Å; M637-N639 PolarHBondContact O-N 2.64Å; N639-I641 VanDerWaalsContact C-N 3.35Å; N639-I641 PolarHBondContact O-N 3.15Å; N639-I642 PolarHBondContact O-N 2.89Å; N639-T643 PolarHBondContact O-N 3.07Å; N639-T643 PolarHBondContact O-OG1 3.35Å
640	K	89.6	Confident	86.6	Confident	149 Å²	149	103.8 Å²	103.8	65%	0.648	49%	0.491	S	S	*	.	H	α-helix	trans	-64	-37.1	175.9	-167.8	168.1	-174.4	169	0	112.7	N636 M637 K638 L644	N636-K640 WeakPolarHBondContact O-CB 3.33Å; N636-K640 PolarHBondContact O-N 3.44Å; M637-K640 PolarHBondContact O-N 2.77Å; K638-K640 VanDerWaalsContact C-N 3.34Å; K638-K640 PolarHBondContact O-N 2.82Å; K640-L644 HydrophobicContact CG-CD1 4.37Å; K640-L644 VanDerWaalsContact O-CG 3.31Å; K640-L644 WeakPolarHBondContact O-CG 3.44Å; K640-L644 PolarHBondContact O-N 3.04Å; K640-L644 VanDerWaalsContact O-N 3.07Å
641	I	84.5	Confident	86.3	Confident	92 Å²	92	103.9 Å²	103.9	47%	0.472	49%	0.488	S	S	.	.	H	α-helix	trans	-63.2	-48.4	173.6	-70.2	164	0	0	0	110.5	M637 K638 N639 T643 L644 E645	M637-I641 WeakPolarHBondContact O-CG1 3.42Å; M637-I641 PolarHBondContact O-N 2.99Å; K638-I641 PolarHBondContact O-N 2.94Å; N639-I641 VanDerWaalsContact C-N 3.35Å; N639-I641 PolarHBondContact O-N 3.15Å; I641-T643 VanDerWaalsContact C-N 3.31Å; I641-T643 PolarHBondContact O-N 2.94Å; I641-L644 PolarHBondContact O-N 2.92Å; I641-L644 VanDerWaalsContact O-N 3.14Å; I641-E645 HydrophobicContact CG2-CG 4.32Å; I641-E645 WeakPolarHBondContact O-CG 3.44Å; I641-E645 PolarHBondContact O-N 3.18Å
642	I	87.6	Confident	85.9	Confident	71 Å²	71	102.6 Å²	102.6	36%	0.364	48%	0.484	S	S	.	.	H	α-helix	trans	-58.3	-42.9	178.6	-67.3	164.5	0	0	0	111.3	K638 N639 E645 N646	K638-I642 HydrophobicContact CG-CD1 4.21Å; K638-I642 WeakPolarHBondContact O-CG1 3.15Å; K638-I642 PolarHBondContact O-N 3.41Å; N639-I642 PolarHBondContact O-N 2.89Å; I642-E645 PolarHBondContact O-N 3.1Å; I642-N646 WeakPolarHBondContact O-CB 3.49Å; I642-N646 PolarHBondContact O-N 3.48Å; I642-N646 PolarHBondContact O-ND2 3.46Å
643	T	87.6	Confident	85.4	Confident	85 Å²	85	104.4 Å²	104.4	52%	0.521	49%	0.489	S	S	.	.	H	α-helix	trans	-62	-45.5	175.8	-59.8	0	0	0	0	112	N639 I641 N646 E647	N639-T643 PolarHBondContact O-N 3.07Å; N639-T643 PolarHBondContact O-OG1 3.35Å; I641-T643 VanDerWaalsContact C-N 3.31Å; I641-T643 PolarHBondContact O-N 2.94Å; T643-N646 PolarHBondContact O-N 3.5Å; T643-E647 WeakPolarHBondContact O-CB 3.34Å; T643-E647 PolarHBondContact O-N 2.91Å
644	L	85.5	Confident	85.1	Confident	90 Å²	90	106.5 Å²	106.5	47%	0.471	50%	0.495	S	S	.	.	H	α-helix	trans	-65.8	-36	177.3	-72.1	169.7	0	0	0	112.6	K640 I641 E647 T648	K640-L644 HydrophobicContact CG-CD1 4.37Å; K640-L644 VanDerWaalsContact O-CG 3.31Å; K640-L644 WeakPolarHBondContact O-CG 3.44Å; K640-L644 PolarHBondContact O-N 3.04Å; K640-L644 VanDerWaalsContact O-N 3.07Å; I641-L644 PolarHBondContact O-N 2.92Å; I641-L644 VanDerWaalsContact O-N 3.14Å; L644-E647 PolarHBondContact O-N 3.29Å; L644-T648 WeakPolarHBondContact O-CB 3.46Å; L644-T648 PolarHBondContact O-N 2.75Å; L644-T648 PolarHBondContact O-OG1 2.94Å
645	E	83.3	Confident	84.7	Confident	103 Å²	103	104.7 Å²	104.7	48%	0.481	49%	0.488	S	S	.	.	H	α-helix	trans	-64.9	-43.9	174.2	-75.6	-177.9	175	0	0	111.8	I641 I642 T648 K649	I641-E645 HydrophobicContact CG2-CG 4.32Å; I641-E645 WeakPolarHBondContact O-CG 3.44Å; I641-E645 PolarHBondContact O-N 3.18Å; I642-E645 PolarHBondContact O-N 3.1Å; E645-T648 PolarHBondContact O-N 3.18Å; E645-K649 WeakPolarHBondContact O-CG 3.33Å; E645-K649 PolarHBondContact O-N 2.99Å
646	N	87.9	Confident	84.2	Confident	72 Å²	72	105.1 Å²	105.1	39%	0.385	49%	0.489	S	S	.	.	H	α-helix	trans	-67.8	-36.3	176.9	-74.2	-22.3	0	0	0	112.4	I642 T643 R650	I642-N646 WeakPolarHBondContact O-CB 3.49Å; I642-N646 PolarHBondContact O-N 3.48Å; I642-N646 PolarHBondContact O-ND2 3.46Å; T643-N646 PolarHBondContact O-N 3.5Å; N646-R650 PolarHBondContact O-N 2.81Å; N646-R650 VanDerWaalsContact O-N 3.11Å
647	E	82.4	Confident	83.8	Confident	66 Å²	66	103.8 Å²	103.8	31%	0.308	48%	0.479	S	S	.	.	H	α-helix	trans	-65.9	-42	170.4	-158.4	-168.4	158.9	0	0	111.7	T643 L644 K649 R650 R651	T643-E647 WeakPolarHBondContact O-CB 3.34Å; T643-E647 PolarHBondContact O-N 2.91Å; L644-E647 PolarHBondContact O-N 3.29Å; E647-K649 VanDerWaalsContact C-N 3.33Å; E647-K649 PolarHBondContact O-N 2.88Å; E647-R650 PolarHBondContact O-N 3.36Å; E647-R651 WeakPolarHBondContact O-CG 3.23Å; E647-R651 PolarHBondContact O-N 2.82Å; E647-R651 IonicContact OE1-CZ 2.64Å; E647-R651 IonicContact OE1-NE 3.58Å; E647-R651 PolarHBondContact OE1-NE 2.91Å; E647-R651 IonicContact OE1-NH2 2.7Å; E647-R651 PolarHBondContact OE1-NH2 3.38Å; E647-R651 IonicContact OE2-NH2 3.25Å
648	T	81.2	Confident	83.2	Confident	60 Å²	60	102.2 Å²	102.2	37%	0.368	47%	0.473	S	S	.	.	H	α-helix	trans	-65.6	-35.3	177	-52.8	0	0	0	0	111.9	L644 E645 R652	L644-T648 WeakPolarHBondContact O-CB 3.46Å; L644-T648 PolarHBondContact O-N 2.75Å; L644-T648 PolarHBondContact O-OG1 2.94Å; E645-T648 PolarHBondContact O-N 3.18Å; T648-R652 WeakPolarHBondContact O-CG 3.36Å; T648-R652 PolarHBondContact O-N 2.99Å
649	K	84.2	Confident	82.7	Confident	116 Å²	116	103.2 Å²	103.2	50%	0.504	47%	0.473	S	S	.	.	H	α-helix	trans	-60.1	-48.5	170	-74.7	172.8	-175.4	170.6	0	111.2	E645 E647 R652 H653	E645-K649 WeakPolarHBondContact O-CG 3.33Å; E645-K649 PolarHBondContact O-N 2.99Å; E647-K649 VanDerWaalsContact C-N 3.33Å; E647-K649 PolarHBondContact O-N 2.88Å; K649-R652 PolarHBondContact O-N 3.36Å; K649-H653 PolarHBondContact O-N 3.29Å; K649-H653 VanDerWaalsContact O-N 3.08Å
650	R	82.6	Confident	82.1	Confident	172 Å²	172	103.9 Å²	103.9	65%	0.649	48%	0.476	S	S	*	.	H	α-helix	trans	-60.5	-46.5	176.4	-74.7	-176.3	-78.3	-177.7	-1.6	112.4	N646 E647 R652 H653 Y654	N646-R650 PolarHBondContact O-N 2.81Å; N646-R650 VanDerWaalsContact O-N 3.11Å; E647-R650 PolarHBondContact O-N 3.36Å; R650-R652 VanDerWaalsContact C-N 3.34Å; R650-R652 PolarHBondContact O-N 3.41Å; R650-H653 PolarHBondContact O-N 2.84Å; R650-Y654 PolarHBondContact O-N 3.43Å
651	R	82.2	Confident	81.7	Confident	126 Å²	126	103.4 Å²	103.4	48%	0.475	47%	0.469	S	S	.	.	H	α-helix	trans	-59.6	-40.8	175.7	-68.9	175.6	-176.4	-154.8	4.2	112.2	E647 I655	E647-R651 WeakPolarHBondContact O-CG 3.23Å; E647-R651 PolarHBondContact O-N 2.82Å; E647-R651 IonicContact OE1-CZ 2.64Å; E647-R651 IonicContact OE1-NE 3.58Å; E647-R651 PolarHBondContact OE1-NE 2.91Å; E647-R651 IonicContact OE1-NH2 2.7Å; E647-R651 PolarHBondContact OE1-NH2 3.38Å; E647-R651 IonicContact OE2-NH2 3.25Å; R651-I655 WeakPolarHBondContact O-CD1 3.4Å; R651-I655 VanDerWaalsContact O-CG1 3.25Å; R651-I655 WeakPolarHBondContact O-CG1 3.45Å; R651-I655 PolarHBondContact O-N 2.92Å
652	R	78.7	Confident	81.4	Confident	144 Å²	144	104 Å²	104	54%	0.543	47%	0.473	S	S	.	.	H	α-helix	trans	-63.5	-41.6	175.1	-79	-172.5	-65.5	-108.8	-0.7	112.8	T648 K649 R650 I655 E656	T648-R652 WeakPolarHBondContact O-CG 3.36Å; T648-R652 PolarHBondContact O-N 2.99Å; K649-R652 PolarHBondContact O-N 3.36Å; R650-R652 VanDerWaalsContact C-N 3.34Å; R650-R652 PolarHBondContact O-N 3.41Å; R652-I655 PolarHBondContact O-N 3.34Å; R652-E656 PolarHBondContact O-N 2.94Å; R652-E656 VanDerWaalsContact O-N 3.13Å
653	H	80.3	Confident	81.1	Confident	142 Å²	142	107.4 Å²	107.4	66%	0.657	49%	0.488	S	S	*	.	H	α-helix	trans	-62.2	-47.7	177.3	-175.4	68.2	0	0	0	111.6	K649 R650 I655 E656 E657	K649-H653 PolarHBondContact O-N 3.29Å; K649-H653 VanDerWaalsContact O-N 3.08Å; R650-H653 PolarHBondContact O-N 2.84Å; H653-I655 PolarHBondContact O-N 3.28Å; H653-E656 PolarHBondContact O-N 3.05Å; H653-E656 VanDerWaalsContact O-N 3.11Å; H653-E657 PolarHBondContact O-N 3.48Å
654	Y	80.1	Confident	80.6	Confident	131 Å²	131	107.3 Å²	107.3	51%	0.514	49%	0.489	S	S	.	.	H	α-helix	trans	-62.4	-38.9	177.3	-176	-115.4	0	0	0	113.2	R650 E656 E657 L658	R650-Y654 PolarHBondContact O-N 3.43Å; Y654-E656 VanDerWaalsContact C-N 3.29Å; Y654-E656 PolarHBondContact O-N 3.39Å; Y654-E657 PolarHBondContact O-N 3.27Å; Y654-L658 HydrophobicContact CD1-CD1 3.98Å; Y654-L658 HydrophobicContact CE1-CD1 3.55Å; Y654-L658 HydrophobicContact CE1-CG 4.23Å; Y654-L658 HydrophobicContact CE2-CG 4.38Å; Y654-L658 WeakPolarHBondContact O-CG 3.41Å; Y654-L658 PolarHBondContact O-N 3.09Å
655	I	77	Confident	80.4	Confident	84 Å²	84	107 Å²	107	43%	0.431	49%	0.491	S	S	.	.	H	α-helix	trans	-62.3	-36.5	174.1	-72.3	165.4	0	0	0	111.6	R651 R652 H653 R659	R651-I655 WeakPolarHBondContact O-CD1 3.4Å; R651-I655 VanDerWaalsContact O-CG1 3.25Å; R651-I655 WeakPolarHBondContact O-CG1 3.45Å; R651-I655 PolarHBondContact O-N 2.92Å; R652-I655 PolarHBondContact O-N 3.34Å; H653-I655 PolarHBondContact O-N 3.28Å; I655-R659 VanDerWaalsContact O-CG 3.3Å; I655-R659 WeakPolarHBondContact O-CG 3.48Å; I655-R659 PolarHBondContact O-N 2.92Å
656	E	79.1	Confident	80.2	Confident	91 Å²	91	106.2 Å²	106.2	43%	0.425	49%	0.49	S	S	.	.	H	α-helix	trans	-73.8	-38.1	178.2	-158.4	62.1	-159.1	0	0	112.1	R652 H653 Y654 L658 R659 I660	R652-E656 PolarHBondContact O-N 2.94Å; R652-E656 VanDerWaalsContact O-N 3.13Å; H653-E656 PolarHBondContact O-N 3.05Å; H653-E656 VanDerWaalsContact O-N 3.11Å; Y654-E656 VanDerWaalsContact C-N 3.29Å; Y654-E656 PolarHBondContact O-N 3.39Å; E656-L658 VanDerWaalsContact C-N 3.34Å; E656-L658 PolarHBondContact O-N 2.92Å; E656-R659 WeakPolarHBondContact O-CB 3.46Å; E656-R659 PolarHBondContact O-N 3.04Å; E656-R659 WeakPolarHBondContact OE2-CD 3.32Å; E656-R659 IonicContact OE2-CZ 2.65Å; E656-R659 IonicContact OE2-NE 2.57Å; E656-R659 IonicContact OE2-NH1 3.67Å; E656-R659 PolarHBondContact OE2-NH1 3.07Å; E656-I660 WeakPolarHBondContact O-CG1 3.23Å; E656-I660 PolarHBondContact O-N 2.99Å
657	E	79.3	Confident	79.7	Confident	68 Å²	68	105.1 Å²	105.1	32%	0.318	49%	0.49	S	S	.	.	H	α-helix	trans	-58.4	-45	170.7	-170.6	-169.2	161.3	0	0	111.6	H653 Y654 R659 I660 R661	H653-E657 PolarHBondContact O-N 3.48Å; Y654-E657 PolarHBondContact O-N 3.27Å; E657-R659 PolarHBondContact O-N 3.06Å; E657-I660 PolarHBondContact O-N 2.97Å; E657-R661 PolarHBondContact O-N 2.99Å; E657-R661 IonicContact OE1-CZ 2.77Å; E657-R661 IonicContact OE1-NH1 2.59Å; E657-R661 PolarHBondContact OE1-NH1 3.38Å; E657-R661 IonicContact OE1-NH2 3.9Å; E657-R661 PolarHBondContact OE1-NH2 2.87Å
658	L	74.9	Confident	79.7	Confident	74 Å²	74	107.9 Å²	107.9	39%	0.387	50%	0.503	S	S	.	.	H	α-helix	trans	-64.3	-36.3	175.1	-72.3	177.6	0	0	0	112.9	Y654 E656 L662	Y654-L658 HydrophobicContact CD1-CD1 3.98Å; Y654-L658 HydrophobicContact CE1-CD1 3.55Å; Y654-L658 HydrophobicContact CE1-CG 4.23Å; Y654-L658 HydrophobicContact CE2-CG 4.38Å; Y654-L658 WeakPolarHBondContact O-CG 3.41Å; Y654-L658 PolarHBondContact O-N 3.09Å; E656-L658 VanDerWaalsContact C-N 3.34Å; E656-L658 PolarHBondContact O-N 2.92Å; L658-L662 WeakPolarHBondContact O-CB 3.48Å; L658-L662 PolarHBondContact O-N 3.46Å
659	R	78.3	Confident	79.8	Confident	147 Å²	147	110.9 Å²	110.9	56%	0.555	51%	0.513	S	S	*	.	H	α-helix	trans	-64.5	-43.9	174.5	-78.1	165.4	172.3	-179.8	-1.7	112.2	I655 E656 E657 L662 Q663	I655-R659 VanDerWaalsContact O-CG 3.3Å; I655-R659 WeakPolarHBondContact O-CG 3.48Å; I655-R659 PolarHBondContact O-N 2.92Å; E656-R659 WeakPolarHBondContact O-CB 3.46Å; E656-R659 PolarHBondContact O-N 3.04Å; E656-R659 WeakPolarHBondContact OE2-CD 3.32Å; E656-R659 IonicContact OE2-CZ 2.65Å; E656-R659 IonicContact OE2-NE 2.57Å; E656-R659 IonicContact OE2-NH1 3.67Å; E656-R659 PolarHBondContact OE2-NH1 3.07Å; E657-R659 PolarHBondContact O-N 3.06Å; R659-L662 PolarHBondContact O-N 3.19Å; R659-Q663 WeakPolarHBondContact O-CB 3.23Å; R659-Q663 PolarHBondContact O-N 2.93Å
660	I	78.6	Confident	79.8	Confident	99 Å²	99	109 Å²	109	51%	0.508	51%	0.512	S	S	.	.	H	α-helix	trans	-62.1	-47.3	177.2	-67	165.4	0	0	0	109.7	E656 E657 L662 Q663 C664	E656-I660 WeakPolarHBondContact O-CG1 3.23Å; E656-I660 PolarHBondContact O-N 2.99Å; E657-I660 PolarHBondContact O-N 2.97Å; I660-L662 PolarHBondContact O-N 3.21Å; I660-Q663 PolarHBondContact O-N 3.25Å; I660-C664 PolarHBondContact O-N 3.39Å; I660-C664 PolarHBondContact O-SG 2.78Å; I660-C664 VanDerWaalsContact O-SG 3.41Å
661	R	80.3	Confident	79.8	Confident	138 Å²	138	105.8 Å²	105.8	52%	0.521	51%	0.507	S	S	.	.	H	α-helix	trans	-58.6	-45.4	175	-75	-175.9	174.5	135.2	12.1	112.7	E657 Q663 C664 V665	E657-R661 PolarHBondContact O-N 2.99Å; E657-R661 IonicContact OE1-CZ 2.77Å; E657-R661 IonicContact OE1-NH1 2.59Å; E657-R661 PolarHBondContact OE1-NH1 3.38Å; E657-R661 IonicContact OE1-NH2 3.9Å; E657-R661 PolarHBondContact OE1-NH2 2.87Å; R661-Q663 VanDerWaalsContact C-N 3.3Å; R661-Q663 PolarHBondContact O-N 3.42Å; R661-C664 WeakPolarHBondContact O-CB 3.49Å; R661-C664 PolarHBondContact O-N 2.98Å; R661-V665 WeakPolarHBondContact O-CG2 3.44Å; R661-V665 PolarHBondContact O-N 3.23Å
662	L	79	Confident	80	Confident	104 Å²	104	104.9 Å²	104.9	55%	0.545	51%	0.511	S	S	.	.	H	α-helix	trans	-61.4	-38.6	176.7	-179.8	61.8	0	0	0	111.8	L658 R659 I660 V665 L666	L658-L662 WeakPolarHBondContact O-CB 3.48Å; L658-L662 PolarHBondContact O-N 3.46Å; R659-L662 PolarHBondContact O-N 3.19Å; I660-L662 PolarHBondContact O-N 3.21Å; L662-V665 PolarHBondContact O-N 3.49Å; L662-L666 HydrophobicContact CD1-CD1 4.37Å; L662-L666 HydrophobicContact CD1-CG 4.35Å; L662-L666 HydrophobicContact CG-CD1 4.09Å; L662-L666 WeakPolarHBondContact O-CB 3.46Å; L662-L666 VanDerWaalsContact O-CG 3.28Å; L662-L666 WeakPolarHBondContact O-CG 3.36Å; L662-L666 PolarHBondContact O-N 3.15Å
663	Q	80.4	Confident	80.4	Confident	144 Å²	144	107.2 Å²	107.2	67%	0.673	52%	0.52	S	S	*	.	H	α-helix	trans	-65.7	-37.7	176.4	-171.6	172.9	-1.5	0	0	112.3	R659 I660 R661 A667	R659-Q663 WeakPolarHBondContact O-CB 3.23Å; R659-Q663 PolarHBondContact O-N 2.93Å; I660-Q663 PolarHBondContact O-N 3.25Å; R661-Q663 VanDerWaalsContact C-N 3.3Å; R661-Q663 PolarHBondContact O-N 3.42Å; Q663-A667 PolarHBondContact O-N 3.4Å; Q663-A667 VanDerWaalsContact O-N 3.11Å
664	C	77.6	Confident	80.7	Confident	82 Å²	82	104.4 Å²	104.4	55%	0.554	51%	0.51	S	S	*	.	H	α-helix	trans	-63.2	-47.3	172.1	-65.2	0	0	0	0	112	I660 R661 L666 A667 E668	I660-C664 PolarHBondContact O-N 3.39Å; I660-C664 PolarHBondContact O-SG 2.78Å; I660-C664 VanDerWaalsContact O-SG 3.41Å; R661-C664 WeakPolarHBondContact O-CB 3.49Å; R661-C664 PolarHBondContact O-N 2.98Å; C664-L666 VanDerWaalsContact C-N 3.32Å; C664-L666 PolarHBondContact O-N 3.12Å; C664-A667 WeakPolarHBondContact O-CB 3.43Å; C664-A667 PolarHBondContact O-N 3.22Å; C664-A667 VanDerWaalsContact O-N 3.12Å; C664-E668 PolarHBondContact O-N 3.38Å
665	V	80.4	Confident	81	Confident	84 Å²	84	101.6 Å²	101.6	51%	0.509	50%	0.504	S	S	.	.	H	α-helix	trans	-62.3	-37.8	178.3	173.4	0	0	0	0	111.8	R661 L662 A667 E668 Q669	R661-V665 WeakPolarHBondContact O-CG2 3.44Å; R661-V665 PolarHBondContact O-N 3.23Å; L662-V665 PolarHBondContact O-N 3.49Å; V665-A667 VanDerWaalsContact C-N 3.34Å; V665-E668 PolarHBondContact O-N 3.08Å; V665-Q669 WeakPolarHBondContact O-CB 3.17Å; V665-Q669 PolarHBondContact O-N 3.33Å
666	L	79.5	Confident	81.6	Confident	86 Å²	86	102.3 Å²	102.3	45%	0.45	51%	0.508	S	S	.	.	H	α-helix	trans	-68.7	-31	175.4	-72.5	170.5	0	0	0	113	L662 C664 T670	L662-L666 HydrophobicContact CD1-CD1 4.37Å; L662-L666 HydrophobicContact CD1-CG 4.35Å; L662-L666 HydrophobicContact CG-CD1 4.09Å; L662-L666 WeakPolarHBondContact O-CB 3.46Å; L662-L666 VanDerWaalsContact O-CG 3.28Å; L662-L666 WeakPolarHBondContact O-CG 3.36Å; L662-L666 PolarHBondContact O-N 3.15Å; C664-L666 VanDerWaalsContact C-N 3.32Å; C664-L666 PolarHBondContact O-N 3.12Å; L666-T670 PolarHBondContact O-N 3.26Å; L666-T670 PolarHBondContact O-OG1 2.59Å
667	A	77.9	Confident	81.9	Confident	49 Å²	49	102 Å²	102	41%	0.405	51%	0.509	S	S	.	.	H	α-helix	trans	-68.3	-50.5	172.4	0	0	0	0	0	110.6	Q663 C664 V665 Q669 T670 D671	Q663-A667 PolarHBondContact O-N 3.4Å; Q663-A667 VanDerWaalsContact O-N 3.11Å; C664-A667 WeakPolarHBondContact O-CB 3.43Å; C664-A667 PolarHBondContact O-N 3.22Å; C664-A667 VanDerWaalsContact O-N 3.12Å; V665-A667 VanDerWaalsContact C-N 3.34Å; A667-Q669 VanDerWaalsContact C-N 3.32Å; A667-Q669 PolarHBondContact O-N 2.79Å; A667-T670 WeakPolarHBondContact O-CA 3.37Å; A667-T670 VanDerWaalsContact O-CB 3.29Å; A667-T670 WeakPolarHBondContact O-CB 3.49Å; A667-T670 PolarHBondContact O-N 3.45Å; A667-D671 PolarHBondContact O-N 2.98Å
668	E	82	Confident	82.3	Confident	124 Å²	124	102.5 Å²	102.5	58%	0.579	52%	0.517	S	S	*	.	H	α-helix	trans	-58	-41.3	176.9	-172.8	177.4	-169.8	0	0	112.3	C664 V665 T670 D671 L672	C664-E668 PolarHBondContact O-N 3.38Å; V665-E668 PolarHBondContact O-N 3.08Å; E668-T670 VanDerWaalsContact C-N 3.27Å; E668-T670 PolarHBondContact O-N 3.31Å; E668-D671 PolarHBondContact O-N 3.2Å; E668-L672 HydrophobicContact CG-CD1 4.32Å; E668-L672 WeakPolarHBondContact O-CB 3.48Å; E668-L672 WeakPolarHBondContact O-CG 3.46Å; E668-L672 PolarHBondContact O-N 2.97Å
669	Q	84	Confident	83	Confident	124 Å²	124	104.5 Å²	104.5	58%	0.579	52%	0.522	S	S	*	.	H	α-helix	trans	-62	-34.3	173.1	-170.8	-175.6	23.9	0	0	112.6	V665 A667 R673	V665-Q669 WeakPolarHBondContact O-CB 3.17Å; V665-Q669 PolarHBondContact O-N 3.33Å; A667-Q669 VanDerWaalsContact C-N 3.32Å; A667-Q669 PolarHBondContact O-N 2.79Å; Q669-R673 WeakPolarHBondContact O-CB 3.35Å; Q669-R673 PolarHBondContact O-N 3.01Å; Q669-R673 VanDerWaalsContact O-N 3.13Å
670	T	84.7	Confident	83.4	Confident	76 Å²	76	102.3 Å²	102.3	47%	0.466	52%	0.518	S	S	.	.	H	α-helix	trans	-71.1	-41	177.2	-58.3	0	0	0	0	110.8	L666 A667 E668 R673 N674	L666-T670 PolarHBondContact O-N 3.26Å; L666-T670 PolarHBondContact O-OG1 2.59Å; A667-T670 WeakPolarHBondContact O-CA 3.37Å; A667-T670 VanDerWaalsContact O-CB 3.29Å; A667-T670 WeakPolarHBondContact O-CB 3.49Å; A667-T670 PolarHBondContact O-N 3.45Å; E668-T670 VanDerWaalsContact C-N 3.27Å; E668-T670 PolarHBondContact O-N 3.31Å; T670-R673 WeakPolarHBondContact O-CB 3.13Å; T670-R673 PolarHBondContact O-N 3.5Å; T670-N674 VanDerWaalsContact O-CG 3.27Å; T670-N674 PolarHBondContact O-N 3.04Å; T670-N674 PolarHBondContact O-ND2 3.09Å
671	D	81.5	Confident	83.8	Confident	104 Å²	104	103.4 Å²	103.4	56%	0.556	52%	0.519	S	S	*	.	H	α-helix	trans	-68	-44.6	178.1	-66.4	-26.5	0	0	0	111.8	A667 E668 R673 N674 D675	A667-D671 PolarHBondContact O-N 2.98Å; E668-D671 PolarHBondContact O-N 3.2Å; D671-R673 VanDerWaalsContact C-N 3.25Å; D671-R673 PolarHBondContact O-N 3.36Å; D671-N674 WeakPolarHBondContact O-CB 3.5Å; D671-N674 PolarHBondContact O-N 3.48Å; D671-D675 PolarHBondContact O-N 3.07Å
672	L	86.3	Confident	84.2	Confident	107 Å²	107	102.4 Å²	102.4	56%	0.56	52%	0.522	S	S	*	.	H	α-helix	trans	-58.6	-35.8	172.3	-73	170.7	0	0	0	112.5	E668 L676	E668-L672 HydrophobicContact CG-CD1 4.32Å; E668-L672 WeakPolarHBondContact O-CB 3.48Å; E668-L672 WeakPolarHBondContact O-CG 3.46Å; E668-L672 PolarHBondContact O-N 2.97Å; L672-L676 WeakPolarHBondContact O-CB 3.43Å; L672-L676 PolarHBondContact O-N 3.23Å
673	R	87.7	Confident	84.6	Confident	193 Å²	193	101.5 Å²	101.5	73%	0.728	52%	0.518	S	S	*	.	H	α-helix	trans	-69.2	-35.2	175.2	-174.5	177.2	-176.8	157.5	4.6	112.4	Q669 T670 D671 L677	Q669-R673 WeakPolarHBondContact O-CB 3.35Å; Q669-R673 PolarHBondContact O-N 3.01Å; Q669-R673 VanDerWaalsContact O-N 3.13Å; T670-R673 WeakPolarHBondContact O-CB 3.13Å; T670-R673 PolarHBondContact O-N 3.5Å; D671-R673 VanDerWaalsContact C-N 3.25Å; D671-R673 PolarHBondContact O-N 3.36Å; R673-L677 WeakPolarHBondContact O-CB 3.48Å; R673-L677 PolarHBondContact O-N 2.95Å; R673-L677 VanDerWaalsContact O-N 3.09Å
674	N	86.6	Confident	84.9	Confident	84 Å²	84	100.5 Å²	100.5	45%	0.449	51%	0.513	S	S	.	.	H	α-helix	trans	-71.2	-40.1	176	-68.1	-31.2	0	0	0	111.7	T670 D671 L677 T678	T670-N674 VanDerWaalsContact O-CG 3.27Å; T670-N674 PolarHBondContact O-N 3.04Å; T670-N674 PolarHBondContact O-ND2 3.09Å; D671-N674 WeakPolarHBondContact O-CB 3.5Å; D671-N674 PolarHBondContact O-N 3.48Å; N674-L677 PolarHBondContact O-N 3.47Å; N674-T678 PolarHBondContact O-N 3.48Å; N674-T678 PolarHBondContact O-OG1 3.26Å
675	D	87	Confident	85.3	Confident	71 Å²	71	100.6 Å²	100.6	38%	0.38	51%	0.511	S	S	.	.	H	α-helix	trans	-62	-46.8	172.4	174.5	56.1	0	0	0	111.5	D671 L677 T678 K679	D671-D675 PolarHBondContact O-N 3.07Å; D675-L677 VanDerWaalsContact C-N 3.33Å; D675-L677 PolarHBondContact O-N 3.08Å; D675-T678 WeakPolarHBondContact O-CB 3.45Å; D675-T678 PolarHBondContact O-N 2.94Å; D675-T678 VanDerWaalsContact O-N 3.08Å; D675-K679 PolarHBondContact O-N 3.48Å; D675-K679 WeakPolarHBondContact OD1-CE 3.39Å; D675-K679 IonicContact OD1-NZ 2.64Å; D675-K679 PolarHBondContact OD1-NZ 3.36Å; D675-K679 WeakPolarHBondContact OD2-CE 3.43Å; D675-K679 IonicContact OD2-NZ 2.79Å; D675-K679 PolarHBondContact OD2-NZ 2.89Å
676	L	88	Confident	85.6	Confident	99 Å²	99	101.8 Å²	101.8	52%	0.518	51%	0.514	S	S	.	.	H	α-helix	trans	-57.8	-43.5	175.4	-178.9	62.6	0	0	0	112.4	L672 T678 K679 Q680	L672-L676 WeakPolarHBondContact O-CB 3.43Å; L672-L676 PolarHBondContact O-N 3.23Å; L676-T678 VanDerWaalsContact C-N 3.29Å; L676-T678 PolarHBondContact O-N 2.99Å; L676-K679 PolarHBondContact O-N 2.98Å; L676-Q680 WeakPolarHBondContact O-CG 3.36Å; L676-Q680 PolarHBondContact O-N 2.55Å
677	L	86.9	Confident	86	Confident	84 Å²	84	103.4 Å²	103.4	44%	0.44	52%	0.518	S	S	.	.	H	α-helix	trans	-64.7	-34.6	176.7	-178.5	62.7	0	0	0	112.1	R673 N674 D675 K681	R673-L677 WeakPolarHBondContact O-CB 3.48Å; R673-L677 PolarHBondContact O-N 2.95Å; R673-L677 VanDerWaalsContact O-N 3.09Å; N674-L677 PolarHBondContact O-N 3.47Å; D675-L677 VanDerWaalsContact C-N 3.33Å; D675-L677 PolarHBondContact O-N 3.08Å; L677-K681 WeakPolarHBondContact O-CG 3.33Å; L677-K681 PolarHBondContact O-N 3.45Å
678	T	86.7	Confident	86.4	Confident	79 Å²	79	106.7 Å²	106.7	49%	0.485	53%	0.527	S	S	.	.	H	α-helix	trans	-69.6	-44.8	176.7	-55.8	0	0	0	0	110.8	N674 D675 L676 Q680 K681 M682	N674-T678 PolarHBondContact O-N 3.48Å; N674-T678 PolarHBondContact O-OG1 3.26Å; D675-T678 WeakPolarHBondContact O-CB 3.45Å; D675-T678 PolarHBondContact O-N 2.94Å; D675-T678 VanDerWaalsContact O-N 3.08Å; L676-T678 VanDerWaalsContact C-N 3.29Å; L676-T678 PolarHBondContact O-N 2.99Å; T678-Q680 VanDerWaalsContact C-N 3.33Å; T678-Q680 PolarHBondContact O-N 3.28Å; T678-K681 PolarHBondContact O-N 3.34Å; T678-M682 PolarHBondContact O-N 2.95Å
679	K	89	Confident	86.6	Confident	117 Å²	117	103.5 Å²	103.5	51%	0.509	52%	0.519	S	S	.	.	H	α-helix	trans	-62.2	-36.1	173.5	-73.9	170	177.2	163.2	0	112.7	D675 L676 M682 N683	D675-K679 PolarHBondContact O-N 3.48Å; D675-K679 WeakPolarHBondContact OD1-CE 3.39Å; D675-K679 IonicContact OD1-NZ 2.64Å; D675-K679 PolarHBondContact OD1-NZ 3.36Å; D675-K679 WeakPolarHBondContact OD2-CE 3.43Å; D675-K679 IonicContact OD2-NZ 2.79Å; D675-K679 PolarHBondContact OD2-NZ 2.89Å; L676-K679 PolarHBondContact O-N 2.98Å; K679-M682 PolarHBondContact O-N 2.98Å; K679-N683 WeakPolarHBondContact O-CB 3.46Å; K679-N683 PolarHBondContact O-N 2.94Å
680	Q	86.5	Confident	86.6	Confident	100 Å²	100	102.3 Å²	102.3	47%	0.467	51%	0.513	S	S	.	.	H	α-helix	trans	-61.8	-48.8	173.2	-78.2	175.1	-16.1	0	0	112.1	L676 T678 M682 N683 E684	L676-Q680 WeakPolarHBondContact O-CG 3.36Å; L676-Q680 PolarHBondContact O-N 2.55Å; T678-Q680 VanDerWaalsContact C-N 3.33Å; T678-Q680 PolarHBondContact O-N 3.28Å; Q680-M682 VanDerWaalsContact C-N 3.3Å; Q680-M682 PolarHBondContact O-N 3.42Å; Q680-N683 WeakPolarHBondContact O-CB 3.29Å; Q680-N683 PolarHBondContact O-N 2.95Å; Q680-E684 WeakPolarHBondContact O-CG 3.45Å; Q680-E684 PolarHBondContact O-N 2.94Å
681	K	88.1	Confident	86.7	Confident	123 Å²	123	102.2 Å²	102.2	54%	0.535	51%	0.513	S	S	.	.	H	α-helix	trans	-60.8	-38.4	175.5	-69.7	174.5	-179.7	177.2	0	112.8	L677 T678 E684 T685	L677-K681 WeakPolarHBondContact O-CG 3.33Å; L677-K681 PolarHBondContact O-N 3.45Å; T678-K681 PolarHBondContact O-N 3.34Å; K681-E684 PolarHBondContact O-N 3.43Å; K681-T685 WeakPolarHBondContact O-CB 3.39Å; K681-T685 PolarHBondContact O-N 3.02Å; K681-T685 PolarHBondContact O-OG1 3.16Å
682	M	87.9	Confident	86.7	Confident	117 Å²	117	102.9 Å²	102.9	58%	0.576	51%	0.513	S	S	*	.	H	α-helix	trans	-64.7	-43.4	176.2	-169.2	-176.5	-68.1	0	0	111.1	T678 K679 Q680 T685 L686	T678-M682 PolarHBondContact O-N 2.95Å; K679-M682 PolarHBondContact O-N 2.98Å; Q680-M682 VanDerWaalsContact C-N 3.3Å; Q680-M682 PolarHBondContact O-N 3.42Å; M682-T685 WeakPolarHBondContact O-CB 3.48Å; M682-T685 PolarHBondContact O-N 3.21Å; M682-L686 HydrophobicContact CG-CD1 4.42Å; M682-L686 WeakPolarHBondContact O-CG 3.32Å; M682-L686 PolarHBondContact O-N 3.36Å
683	N	88.2	Confident	86.6	Confident	84 Å²	84	104.1 Å²	104.1	45%	0.449	52%	0.519	S	S	.	.	H	α-helix	trans	-64.2	-41.1	175.2	-171.7	15.1	0	0	0	112.5	K679 Q680 T685 L686 K687	K679-N683 WeakPolarHBondContact O-CB 3.46Å; K679-N683 PolarHBondContact O-N 2.94Å; Q680-N683 WeakPolarHBondContact O-CB 3.29Å; Q680-N683 PolarHBondContact O-N 2.95Å; N683-T685 VanDerWaalsContact C-N 3.32Å; N683-T685 PolarHBondContact O-N 3.38Å; N683-L686 PolarHBondContact O-N 2.91Å; N683-K687 WeakPolarHBondContact O-CB 3.39Å; N683-K687 WeakPolarHBondContact O-CG 3.16Å; N683-K687 PolarHBondContact O-N 3.19Å
684	E	86.1	Confident	86.6	Confident	124 Å²	124	100.4 Å²	100.4	58%	0.579	51%	0.508	S	S	*	.	H	α-helix	trans	-60.2	-42.1	172.4	-72.6	174.5	172.9	0	0	111.8	Q680 K681 K687 L688	Q680-E684 WeakPolarHBondContact O-CG 3.45Å; Q680-E684 PolarHBondContact O-N 2.94Å; K681-E684 PolarHBondContact O-N 3.43Å; E684-K687 PolarHBondContact O-N 2.87Å; E684-L688 WeakPolarHBondContact O-CG 3.35Å; E684-L688 PolarHBondContact O-N 3.26Å
685	T	87.3	Confident	86.5	Confident	83 Å²	83	102 Å²	102	51%	0.509	51%	0.513	S	S	.	.	H	α-helix	trans	-64.9	-45.6	176.7	-53.3	0	0	0	0	111.2	K681 M682 N683 K687 L688 S689	K681-T685 WeakPolarHBondContact O-CB 3.39Å; K681-T685 PolarHBondContact O-N 3.02Å; K681-T685 PolarHBondContact O-OG1 3.16Å; M682-T685 WeakPolarHBondContact O-CB 3.48Å; M682-T685 PolarHBondContact O-N 3.21Å; N683-T685 VanDerWaalsContact C-N 3.32Å; N683-T685 PolarHBondContact O-N 3.38Å; T685-K687 PolarHBondContact O-N 2.89Å; T685-L688 WeakPolarHBondContact O-CB 3.4Å; T685-L688 PolarHBondContact O-N 3.41Å; T685-S689 PolarHBondContact O-N 3.27Å; T685-S689 PolarHBondContact O-OG 3.19Å
686	L	86.8	Confident	86.2	Confident	110 Å²	110	102.2 Å²	102.2	58%	0.576	52%	0.517	S	S	*	.	H	α-helix	trans	-61	-41.4	176.1	-73.9	170	0	0	0	112.2	M682 N683 L688 S689 E690	M682-L686 HydrophobicContact CG-CD1 4.42Å; M682-L686 WeakPolarHBondContact O-CG 3.32Å; M682-L686 PolarHBondContact O-N 3.36Å; N683-L686 PolarHBondContact O-N 2.91Å; L686-L688 PolarHBondContact O-N 3.43Å; L686-S689 PolarHBondContact O-N 2.94Å; L686-E690 WeakPolarHBondContact O-CB 3.31Å; L686-E690 PolarHBondContact O-N 2.87Å
687	K	87	Confident	85.9	Confident	120 Å²	120	102.9 Å²	102.9	52%	0.522	52%	0.515	S	S	.	.	H	α-helix	trans	-62.4	-40	174.2	-75	177	179.2	-174.7	0	112.5	N683 E684 T685 E690 V691	N683-K687 WeakPolarHBondContact O-CB 3.39Å; N683-K687 WeakPolarHBondContact O-CG 3.16Å; N683-K687 PolarHBondContact O-N 3.19Å; E684-K687 PolarHBondContact O-N 2.87Å; T685-K687 PolarHBondContact O-N 2.89Å; K687-E690 PolarHBondContact O-N 3.45Å; K687-V691 WeakPolarHBondContact O-CG2 3.37Å; K687-V691 PolarHBondContact O-N 2.91Å
688	L	85.6	Confident	85.7	Confident	117 Å²	117	104.9 Å²	104.9	61%	0.613	52%	0.523	S	S	*	.	H	α-helix	trans	-63.9	-43.7	174.2	-72.2	168.5	0	0	0	111.4	E684 T685 L686 V691 Q692	E684-L688 WeakPolarHBondContact O-CG 3.35Å; E684-L688 PolarHBondContact O-N 3.26Å; T685-L688 WeakPolarHBondContact O-CB 3.4Å; T685-L688 PolarHBondContact O-N 3.41Å; L686-L688 PolarHBondContact O-N 3.43Å; L688-V691 PolarHBondContact O-N 3.29Å; L688-Q692 WeakPolarHBondContact O-CG 3.39Å; L688-Q692 PolarHBondContact O-N 2.88Å
689	S	86.1	Confident	85.3	Confident	57 Å²	57	103.9 Å²	103.9	40%	0.399	52%	0.518	S	S	.	.	H	α-helix	trans	-63.1	-38.5	174.1	-61.3	0	0	0	0	112.8	T685 L686 Q692 L693	T685-S689 PolarHBondContact O-N 3.27Å; T685-S689 PolarHBondContact O-OG 3.19Å; L686-S689 PolarHBondContact O-N 2.94Å; S689-Q692 PolarHBondContact O-N 3.49Å; S689-L693 WeakPolarHBondContact O-CB 3.46Å; S689-L693 PolarHBondContact O-N 2.83Å
690	E	84.7	Confident	84.9	Confident	99 Å²	99	103.5 Å²	103.5	46%	0.463	52%	0.519	S	S	.	.	H	α-helix	trans	-63.7	-42.5	175.7	-166.1	-161.6	152.3	0	0	111.7	L686 K687 L693 K694	L686-E690 WeakPolarHBondContact O-CB 3.31Å; L686-E690 PolarHBondContact O-N 2.87Å; K687-E690 PolarHBondContact O-N 3.45Å; E690-L693 PolarHBondContact O-N 3.47Å; E690-K694 WeakPolarHBondContact O-CG 3.48Å; E690-K694 PolarHBondContact O-N 3.35Å; E690-K694 WeakPolarHBondContact OE1-CE 3.41Å; E690-K694 IonicContact OE1-NZ 3.6Å; E690-K694 PolarHBondContact OE1-NZ 3.02Å
691	V	86.3	Confident	84.7	Confident	75 Å²	75	104.2 Å²	104.2	46%	0.455	52%	0.522	S	S	.	.	H	α-helix	trans	-63.2	-43.6	174.9	170.4	0	0	0	0	111.2	K687 L688 L693 K694 Q695	K687-V691 WeakPolarHBondContact O-CG2 3.37Å; K687-V691 PolarHBondContact O-N 2.91Å; L688-V691 PolarHBondContact O-N 3.29Å; V691-L693 VanDerWaalsContact C-N 3.34Å; V691-L693 PolarHBondContact O-N 3.44Å; V691-K694 PolarHBondContact O-N 2.98Å; V691-Q695 WeakPolarHBondContact O-CG 3.41Å; V691-Q695 PolarHBondContact O-N 3.38Å
692	Q	81.8	Confident	84.4	Confident	118 Å²	118	103.5 Å²	103.5	55%	0.551	52%	0.523	S	S	*	.	H	α-helix	trans	-61.1	-42.1	174.3	-72.8	173.8	-18.5	0	0	111.7	L688 S689 Q695 T696	L688-Q692 WeakPolarHBondContact O-CG 3.39Å; L688-Q692 PolarHBondContact O-N 2.88Å; S689-Q692 PolarHBondContact O-N 3.49Å; Q692-Q695 PolarHBondContact O-N 3.35Å; Q692-T696 WeakPolarHBondContact O-CB 3.36Å; Q692-T696 PolarHBondContact O-N 3.04Å; Q692-T696 PolarHBondContact O-OG1 2.57Å
693	L	85.4	Confident	83.7	Confident	132 Å²	132	103 Å²	103	69%	0.691	52%	0.519	S	S	*	.	H	α-helix	trans	-65.7	-39.4	178.5	-152.3	109.5	0	0	0	111.7	S689 E690 V691 T696 K697	S689-L693 WeakPolarHBondContact O-CB 3.46Å; S689-L693 PolarHBondContact O-N 2.83Å; E690-L693 PolarHBondContact O-N 3.47Å; V691-L693 VanDerWaalsContact C-N 3.34Å; V691-L693 PolarHBondContact O-N 3.44Å; L693-T696 PolarHBondContact O-N 3.03Å; L693-K697 WeakPolarHBondContact O-CB 3.4Å; L693-K697 PolarHBondContact O-N 3.33Å
694	K	86.2	Confident	83.4	Confident	115 Å²	115	103 Å²	103	50%	0.5	52%	0.519	S	S	.	.	H	α-helix	trans	-62.7	-43.9	172.9	-76.2	174.8	-179.3	170.5	0	112.2	E690 V691 T696 K697 Q698	E690-K694 WeakPolarHBondContact O-CG 3.48Å; E690-K694 PolarHBondContact O-N 3.35Å; E690-K694 WeakPolarHBondContact OE1-CE 3.41Å; E690-K694 IonicContact OE1-NZ 3.6Å; E690-K694 PolarHBondContact OE1-NZ 3.02Å; V691-K694 PolarHBondContact O-N 2.98Å; K694-T696 VanDerWaalsContact C-N 3.33Å; K694-T696 PolarHBondContact O-N 3.43Å; K694-K697 PolarHBondContact O-N 3.47Å; K694-Q698 WeakPolarHBondContact O-CG 3.39Å; K694-Q698 PolarHBondContact O-N 3.35Å
695	Q	83.9	Confident	83.3	Confident	118 Å²	118	100.7 Å²	100.7	55%	0.551	51%	0.509	S	S	*	.	H	α-helix	trans	-62.7	-39.4	174.3	-72.8	174.6	-9.9	0	0	111.9	V691 Q692 Q698 S699	V691-Q695 WeakPolarHBondContact O-CG 3.41Å; V691-Q695 PolarHBondContact O-N 3.38Å; Q692-Q695 PolarHBondContact O-N 3.35Å; Q695-Q698 PolarHBondContact O-N 3.32Å; Q695-S699 WeakPolarHBondContact O-CB 3.44Å; Q695-S699 PolarHBondContact O-N 3.39Å
696	T	81.7	Confident	82.9	Confident	75 Å²	75	99.5 Å²	99.5	46%	0.46	50%	0.502	S	S	.	.	H	α-helix	trans	-65.5	-45	176.4	-56.6	0	0	0	0	111.1	Q692 L693 K694 Q698 S699 Q700	Q692-T696 WeakPolarHBondContact O-CB 3.36Å; Q692-T696 PolarHBondContact O-N 3.04Å; Q692-T696 PolarHBondContact O-OG1 2.57Å; L693-T696 PolarHBondContact O-N 3.03Å; K694-T696 VanDerWaalsContact C-N 3.33Å; K694-T696 PolarHBondContact O-N 3.43Å; T696-Q698 VanDerWaalsContact C-N 3.35Å; T696-Q698 PolarHBondContact O-N 3.4Å; T696-S699 PolarHBondContact O-N 3.19Å; T696-Q700 WeakPolarHBondContact O-CG 3.18Å; T696-Q700 PolarHBondContact O-N 3.49Å
697	K	82.7	Confident	82.4	Confident	113 Å²	113	97.7 Å²	97.7	49%	0.491	49%	0.493	S	S	.	.	H	α-helix	trans	-59.3	-43.3	174.4	-174.5	-176.7	177.8	-170.6	0	111.7	L693 K694 Q700 H701 E880	L693-K697 WeakPolarHBondContact O-CB 3.4Å; L693-K697 PolarHBondContact O-N 3.33Å; K694-K697 PolarHBondContact O-N 3.47Å; K697-Q700 PolarHBondContact O-N 3.13Å; K697-H701 WeakPolarHBondContact O-CB 3.31Å; K697-H701 PolarHBondContact O-N 3.27Å; K697-E880 IonicContact NZ-OE1 2.6Å; K697-E880 PolarHBondContact NZ-OE1 2.89Å
698	Q	82.1	Confident	82.1	Confident	127 Å²	127	97.7 Å²	97.7	59%	0.593	50%	0.496	S	S	*	.	H	α-helix	trans	-62.7	-45.5	175.1	-75.5	175.5	-21.7	0	0	111.9	K694 Q695 T696 Q700 H701 I702	K694-Q698 WeakPolarHBondContact O-CG 3.39Å; K694-Q698 PolarHBondContact O-N 3.35Å; Q695-Q698 PolarHBondContact O-N 3.32Å; T696-Q698 VanDerWaalsContact C-N 3.35Å; T696-Q698 PolarHBondContact O-N 3.4Å; Q698-Q700 PolarHBondContact O-N 3.07Å; Q698-H701 PolarHBondContact O-N 3.36Å; Q698-I702 WeakPolarHBondContact O-CG1 3.3Å; Q698-I702 PolarHBondContact O-N 3.07Å
699	S	78.4	Confident	81.9	Confident	57 Å²	57	97 Å²	97	40%	0.399	49%	0.493	S	S	.	.	H	α-helix	trans	-59.7	-46.1	175.8	-177.8	0	0	0	0	112.1	Q695 T696 H701 I702 Q703	Q695-S699 WeakPolarHBondContact O-CB 3.44Å; Q695-S699 PolarHBondContact O-N 3.39Å; T696-S699 PolarHBondContact O-N 3.19Å; S699-H701 VanDerWaalsContact C-N 3.34Å; S699-H701 PolarHBondContact O-N 3.37Å; S699-I702 PolarHBondContact O-N 2.78Å; S699-Q703 VanDerWaalsContact O-CG 3.26Å; S699-Q703 WeakPolarHBondContact O-CG 3.44Å; S699-Q703 PolarHBondContact O-N 3.42Å; S699-Q703 PolarHBondContact O-NE2 3Å; S699-Q703 PolarHBondContact OG-NE2 3.34Å; S699-Q703 VanDerWaalsContact OG-NE2 3.13Å
700	Q	80.5	Confident	81.5	Confident	110 Å²	110	97.8 Å²	97.8	51%	0.514	49%	0.49	S	S	.	.	H	α-helix	trans	-62.4	-38.5	175.4	-73	174.7	-15.5	0	0	112.4	T696 K697 Q698 Q703 L704	T696-Q700 WeakPolarHBondContact O-CG 3.18Å; T696-Q700 PolarHBondContact O-N 3.49Å; K697-Q700 PolarHBondContact O-N 3.13Å; Q698-Q700 PolarHBondContact O-N 3.07Å; Q700-Q703 PolarHBondContact O-N 3.42Å; Q700-L704 PolarHBondContact O-N 2.96Å
701	H	82	Confident	81.3	Confident	115 Å²	115	98.4 Å²	98.4	53%	0.532	49%	0.491	S	S	.	.	H	α-helix	trans	-66.6	-42.4	177.2	-171.3	60.8	0	0	0	112.1	K697 Q698 S699 Q703 L704 I705	K697-H701 WeakPolarHBondContact O-CB 3.31Å; K697-H701 PolarHBondContact O-N 3.27Å; Q698-H701 PolarHBondContact O-N 3.36Å; S699-H701 VanDerWaalsContact C-N 3.34Å; S699-H701 PolarHBondContact O-N 3.37Å; H701-Q703 VanDerWaalsContact C-N 3.34Å; H701-Q703 PolarHBondContact O-N 3.3Å; H701-L704 PolarHBondContact O-N 3Å; H701-I705 WeakPolarHBondContact O-CG1 3.37Å; H701-I705 PolarHBondContact O-N 3.27Å
702	I	81.8	Confident	81.1	Confident	108 Å²	108	100.8 Å²	100.8	55%	0.554	50%	0.496	S	S	*	.	H	α-helix	trans	-61.7	-41.7	173.6	-67.4	164.6	0	0	0	111.1	Q698 S699 I705 T706	Q698-I702 WeakPolarHBondContact O-CG1 3.3Å; Q698-I702 PolarHBondContact O-N 3.07Å; S699-I702 PolarHBondContact O-N 2.78Å; I702-I705 PolarHBondContact O-N 3.47Å; I702-T706 PolarHBondContact O-N 3.11Å; I702-T706 PolarHBondContact O-OG1 2.97Å
703	Q	74	Confident	81	Confident	105 Å²	105	99.1 Å²	99.1	49%	0.491	49%	0.49	S	S	.	.	H	α-helix	trans	-61.8	-43	174.9	-70.6	169.7	42.5	0	0	111.8	S699 Q700 H701 T706 L707	S699-Q703 VanDerWaalsContact O-CG 3.26Å; S699-Q703 WeakPolarHBondContact O-CG 3.44Å; S699-Q703 PolarHBondContact O-N 3.42Å; S699-Q703 PolarHBondContact O-NE2 3Å; S699-Q703 PolarHBondContact OG-NE2 3.34Å; S699-Q703 VanDerWaalsContact OG-NE2 3.13Å; Q700-Q703 PolarHBondContact O-N 3.42Å; H701-Q703 VanDerWaalsContact C-N 3.34Å; H701-Q703 PolarHBondContact O-N 3.3Å; Q703-T706 WeakPolarHBondContact O-CB 3.42Å; Q703-T706 PolarHBondContact O-N 3.42Å; Q703-L707 WeakPolarHBondContact O-CG 3.34Å; Q703-L707 PolarHBondContact O-N 3Å
704	L	81.4	Confident	80.5	Confident	86 Å²	86	94.3 Å²	94.3	45%	0.45	47%	0.465	S	S	.	.	H	α-helix	trans	-62.9	-43.1	176.7	-175	65.4	0	0	0	112.1	Q700 H701 T706 L707 M708	Q700-L704 PolarHBondContact O-N 2.96Å; H701-L704 PolarHBondContact O-N 3Å; L704-T706 VanDerWaalsContact C-N 3.29Å; L704-T706 PolarHBondContact O-N 3.28Å; L704-L707 PolarHBondContact O-N 3.01Å; L704-M708 HydrophobicContact CG-SD 4.4Å; L704-M708 WeakPolarHBondContact O-CB 3.32Å; L704-M708 WeakPolarHBondContact O-CG 3.4Å; L704-M708 PolarHBondContact O-N 2.89Å
705	I	83.4	Confident	80	Confident	75 Å²	75	93 Å²	93	39%	0.385	46%	0.463	S	S	.	.	H	α-helix	trans	-60.1	-41.1	175.1	-68.9	165.3	0	0	0	110.8	H701 I702 M708 N709	H701-I705 WeakPolarHBondContact O-CG1 3.37Å; H701-I705 PolarHBondContact O-N 3.27Å; I702-I705 PolarHBondContact O-N 3.47Å; I705-M708 PolarHBondContact O-N 2.9Å; I705-N709 PolarHBondContact O-N 2.8Å; I705-N709 PolarHBondContact O-ND2 3.33Å
706	T	80	Confident	79.8	Confident	58 Å²	58	92 Å²	92	36%	0.356	46%	0.459	S	S	.	.	H	α-helix	trans	-63.7	-47.9	177.8	-53.3	0	0	0	0	110.9	I702 Q703 L704 M708 N709 E710	I702-T706 PolarHBondContact O-N 3.11Å; I702-T706 PolarHBondContact O-OG1 2.97Å; Q703-T706 WeakPolarHBondContact O-CB 3.42Å; Q703-T706 PolarHBondContact O-N 3.42Å; L704-T706 VanDerWaalsContact C-N 3.29Å; L704-T706 PolarHBondContact O-N 3.28Å; T706-M708 VanDerWaalsContact C-N 3.32Å; T706-M708 PolarHBondContact O-N 2.81Å; T706-N709 PolarHBondContact O-N 3.06Å; T706-E710 WeakPolarHBondContact O-CG 3.49Å; T706-E710 PolarHBondContact O-N 3.32Å
707	L	74.8	Confident	79.5	Confident	72 Å²	72	90.9 Å²	90.9	38%	0.377	45%	0.45	S	S	.	.	H	α-helix	trans	-62.7	-35	176.2	-70.5	170.8	0	0	0	112.9	Q703 L704 K711	Q703-L707 WeakPolarHBondContact O-CG 3.34Å; Q703-L707 PolarHBondContact O-N 3Å; L704-L707 PolarHBondContact O-N 3.01Å; L707-K711 WeakPolarHBondContact O-CB 3.43Å; L707-K711 PolarHBondContact O-N 3.45Å
708	M	81.1	Confident	79.1	Confident	120 Å²	120	88.6 Å²	88.6	59%	0.591	44%	0.44	S	S	*	.	H	α-helix	trans	-66.6	-40.8	174.1	-76.2	-179.4	63.1	0	0	112.1	L704 I705 T706 K711 K712	L704-M708 HydrophobicContact CG-SD 4.4Å; L704-M708 WeakPolarHBondContact O-CB 3.32Å; L704-M708 WeakPolarHBondContact O-CG 3.4Å; L704-M708 PolarHBondContact O-N 2.89Å; I705-M708 PolarHBondContact O-N 2.9Å; T706-M708 VanDerWaalsContact C-N 3.32Å; T706-M708 PolarHBondContact O-N 2.81Å; M708-K711 PolarHBondContact O-N 2.93Å; M708-K712 WeakPolarHBondContact O-CB 3.47Å; M708-K712 PolarHBondContact O-N 3.36Å
709	N	82.5	Confident	78.9	Confident	102 Å²	102	87.9 Å²	87.9	55%	0.545	44%	0.436	S	S	.	.	H	α-helix	trans	-67.7	-41.4	175.7	-71.5	-20.4	0	0	0	111.8	I705 T706 K712 N713	I705-N709 PolarHBondContact O-N 2.8Å; I705-N709 PolarHBondContact O-ND2 3.33Å; T706-N709 PolarHBondContact O-N 3.06Å; N709-K712 PolarHBondContact O-N 3.31Å; N709-N713 WeakPolarHBondContact O-CB 3.42Å; N709-N713 PolarHBondContact O-N 3.32Å
710	E	77.6	Confident	78.8	Confident	73 Å²	73	89.8 Å²	89.8	34%	0.341	44%	0.441	S	S	.	.	H	α-helix	trans	-59.7	-47.3	172.5	-72.9	173.4	-172.2	0	0	111.1	T706 K712 N713 I714	T706-E710 WeakPolarHBondContact O-CG 3.49Å; T706-E710 PolarHBondContact O-N 3.32Å; E710-K712 VanDerWaalsContact C-N 3.35Å; E710-K712 PolarHBondContact O-N 3.34Å; E710-N713 PolarHBondContact O-N 3Å; E710-I714 WeakPolarHBondContact O-CD1 3.39Å; E710-I714 VanDerWaalsContact O-CG1 3.28Å; E710-I714 WeakPolarHBondContact O-CG1 3.38Å; E710-I714 PolarHBondContact O-N 3.14Å
711	K	78.6	Confident	78.5	Confident	113 Å²	113	85.6 Å²	85.6	49%	0.491	42%	0.422	S	S	.	.	H	α-helix	trans	-58	-44.2	174.7	-179.2	-177.1	175.5	-175.9	0	112.2	L707 M708 I714 L715	L707-K711 WeakPolarHBondContact O-CB 3.43Å; L707-K711 PolarHBondContact O-N 3.45Å; M708-K711 PolarHBondContact O-N 2.93Å; K711-I714 PolarHBondContact O-N 3.02Å; K711-L715 HydrophobicContact CG-CD1 4.16Å; K711-L715 WeakPolarHBondContact O-CG 3.48Å; K711-L715 PolarHBondContact O-N 2.87Å
712	K	83.4	Confident	78.2	Confident	125 Å²	125	86.7 Å²	86.7	54%	0.543	43%	0.425	S	S	.	.	H	α-helix	trans	-60.4	-47.9	177.7	-179.9	177.4	168.5	179	0	111.2	M708 N709 E710 I714 L715 E716	M708-K712 WeakPolarHBondContact O-CB 3.47Å; M708-K712 PolarHBondContact O-N 3.36Å; N709-K712 PolarHBondContact O-N 3.31Å; E710-K712 VanDerWaalsContact C-N 3.35Å; E710-K712 PolarHBondContact O-N 3.34Å; K712-I714 PolarHBondContact O-N 3.48Å; K712-L715 PolarHBondContact O-N 2.86Å; K712-E716 WeakPolarHBondContact CE-OE1 3.45Å; K712-E716 IonicContact NZ-OE1 3.69Å; K712-E716 WeakPolarHBondContact O-CG 3.39Å; K712-E716 PolarHBondContact O-N 2.89Å
713	N	79.7	Confident	78	Confident	82 Å²	82	86.6 Å²	86.6	44%	0.439	42%	0.423	S	S	.	.	H	α-helix	trans	-59.7	-42.6	176.9	-173.2	4.1	0	0	0	111.7	N709 E710 L715 E716 N717	N709-N713 WeakPolarHBondContact O-CB 3.42Å; N709-N713 PolarHBondContact O-N 3.32Å; E710-N713 PolarHBondContact O-N 3Å; N713-L715 PolarHBondContact O-N 2.66Å; N713-E716 PolarHBondContact O-N 3.33Å; N713-N717 PolarHBondContact O-N 2.65Å; N713-N717 PolarHBondContact O-ND2 2.98Å; N713-N717 PolarHBondContact OD1-ND2 2.94Å
714	I	74.5	Confident	77.8	Confident	31 Å²	31	84.5 Å²	84.5	16%	0.159	42%	0.42	C	S	.	.	H	α-helix	trans	-65.8	-38.1	176.9	-56.6	155.7	0	0	0	111.5	E710 K711 K712 N717 F718 I784 W897	E710-I714 WeakPolarHBondContact O-CD1 3.39Å; E710-I714 VanDerWaalsContact O-CG1 3.28Å; E710-I714 WeakPolarHBondContact O-CG1 3.38Å; E710-I714 PolarHBondContact O-N 3.14Å; K711-I714 PolarHBondContact O-N 3.02Å; K712-I714 PolarHBondContact O-N 3.48Å; I714-N717 PolarHBondContact O-N 3.33Å; I714-F718 WeakPolarHBondContact O-CB 3.11Å; I714-F718 PolarHBondContact O-N 3.48Å; I714-I784 HydrophobicContact CD1-CD1 3.48Å; I714-I784 VanDerWaalsContact CD1-CD1 3.48Å; I714-I784 HydrophobicContact CG1-CD1 4.32Å; I714-W897 HydrophobicContact CB-CH2 4.17Å; I714-W897 HydrophobicContact CB-CZ3 3.99Å; I714-W897 HydrophobicContact CD1-CZ3 3.97Å; I714-W897 HydrophobicContact CG2-CH2 3.73Å; I714-W897 HydrophobicContact CG2-CZ3 3.54Å
715	L	76.2	Confident	77.5	Confident	87 Å²	87	83.2 Å²	83.2	46%	0.455	41%	0.411	S	S	.	.	H	α-helix	trans	-65	-40	175	-73	169.6	0	0	0	112.4	K711 K712 N713 F718 H719 W897	K711-L715 HydrophobicContact CG-CD1 4.16Å; K711-L715 WeakPolarHBondContact O-CG 3.48Å; K711-L715 PolarHBondContact O-N 2.87Å; K712-L715 PolarHBondContact O-N 2.86Å; N713-L715 PolarHBondContact O-N 2.66Å; L715-F718 PolarHBondContact O-N 2.93Å; L715-H719 WeakPolarHBondContact O-CB 3.34Å; L715-H719 PolarHBondContact O-N 3.48Å; L715-W897 HydrophobicContact CD2-CH2 4.42Å; L715-W897 HydrophobicContact CD2-CZ2 4.28Å
716	E	79.5	Confident	77.2	Confident	99 Å²	99	83.5 Å²	83.5	46%	0.463	41%	0.413	S	S	.	.	H	α-helix	trans	-62.6	-44.2	173.6	-73.2	170	-180	0	0	111.2	K712 N713 F718 H719 L720	K712-E716 WeakPolarHBondContact CE-OE1 3.45Å; K712-E716 IonicContact NZ-OE1 3.69Å; K712-E716 WeakPolarHBondContact O-CG 3.39Å; K712-E716 PolarHBondContact O-N 2.89Å; N713-E716 PolarHBondContact O-N 3.33Å; E716-F718 VanDerWaalsContact C-N 3.35Å; E716-F718 PolarHBondContact O-N 3.48Å; E716-H719 WeakPolarHBondContact O-CB 3.18Å; E716-H719 PolarHBondContact O-N 3Å; E716-L720 WeakPolarHBondContact O-CG 3.2Å; E716-L720 PolarHBondContact O-N 3.27Å
717	N	75.9	Confident	77.1	Confident	51 Å²	51	85.5 Å²	85.5	27%	0.273	42%	0.419	S	S	.	.	H	α-helix	trans	-62.8	-37.8	173.8	-70.2	-49.6	0	0	0	112.8	N713 I714 L720 L721 L777	N713-N717 PolarHBondContact O-N 2.65Å; N713-N717 PolarHBondContact O-ND2 2.98Å; N713-N717 PolarHBondContact OD1-ND2 2.94Å; I714-N717 PolarHBondContact O-N 3.33Å; N717-L720 PolarHBondContact O-N 2.91Å; N717-L721 WeakPolarHBondContact O-CB 3.48Å; N717-L721 PolarHBondContact O-N 3.41Å; N717-L777 HydrophobicContact CB-CD2 4.49Å
718	F	73.7	Confident	76.8	Confident	64 Å²	64	83.7 Å²	83.7	28%	0.281	41%	0.409	S	S	.	.	H	α-helix	trans	-68	-35.8	174.9	-125.1	-81.3	0	0	0	112.2	I714 L715 E716 L721 K722 L904	I714-F718 WeakPolarHBondContact O-CB 3.11Å; I714-F718 PolarHBondContact O-N 3.48Å; L715-F718 PolarHBondContact O-N 2.93Å; E716-F718 VanDerWaalsContact C-N 3.35Å; E716-F718 PolarHBondContact O-N 3.48Å; F718-L721 PolarHBondContact O-N 3.35Å; F718-K722 WeakPolarHBondContact O-CB 3.36Å; F718-K722 PolarHBondContact O-N 2.83Å; F718-L904 HydrophobicContact CZ-CD1 4.46Å
719	H	77.3	Confident	76.4	Confident	113 Å²	113	80.3 Å²	80.3	52%	0.523	39%	0.393	S	S	.	.	H	α-helix	trans	-66.1	-44.5	174.6	-170.5	-81.4	0	0	0	111.4	L715 E716 K722 Q723	L715-H719 WeakPolarHBondContact O-CB 3.34Å; L715-H719 PolarHBondContact O-N 3.48Å; E716-H719 WeakPolarHBondContact O-CB 3.18Å; E716-H719 PolarHBondContact O-N 3Å; H719-K722 PolarHBondContact O-N 3.25Å; H719-Q723 VanDerWaalsContact CE1-CD 3.48Å; H719-Q723 PolarHBondContact CE1-NE2 2.85Å; H719-Q723 PolarHBondContact ND1-OE1 3.47Å; H719-Q723 WeakPolarHBondContact O-CG 3.37Å; H719-Q723 PolarHBondContact O-N 2.77Å
720	L	76.8	Confident	76.2	Confident	97 Å²	97	80 Å²	80	51%	0.508	39%	0.391	S	S	.	.	H	α-helix	trans	-59.2	-46.8	173.3	-73.4	166.4	0	0	0	111.6	E716 N717 K722 Q723 S724	E716-L720 WeakPolarHBondContact O-CG 3.2Å; E716-L720 PolarHBondContact O-N 3.27Å; N717-L720 PolarHBondContact O-N 2.91Å; L720-K722 VanDerWaalsContact C-N 3.33Å; L720-K722 PolarHBondContact O-N 3.46Å; L720-Q723 PolarHBondContact O-N 2.96Å; L720-S724 PolarHBondContact O-N 2.97Å; L720-S724 PolarHBondContact O-OG 3Å
721	L	73.4	Confident	75.9	Confident	21 Å²	21	80.4 Å²	80.4	11%	0.11	39%	0.393	C	S	.	.	H	α-helix	trans	-56.7	-45.7	174.6	-179.5	75.4	0	0	0	111.7	N717 F718 Q723 S724 H725 T773 L777	N717-L721 WeakPolarHBondContact O-CB 3.48Å; N717-L721 PolarHBondContact O-N 3.41Å; F718-L721 PolarHBondContact O-N 3.35Å; L721-Q723 VanDerWaalsContact C-N 3.34Å; L721-Q723 PolarHBondContact O-N 3.27Å; L721-S724 PolarHBondContact O-N 2.88Å; L721-H725 WeakPolarHBondContact O-CB 3.37Å; L721-H725 PolarHBondContact O-N 2.89Å; L721-T773 HydrophobicContact CD1-CG2 3.63Å; L721-L777 HydrophobicContact CD1-CD1 4.06Å; L721-L777 HydrophobicContact CD2-CD1 3.69Å; L721-L777 HydrophobicContact CG-CD1 4.32Å
722	K	77.3	Confident	75.6	Confident	138 Å²	138	77.8 Å²	77.8	60%	0.6	38%	0.384	S	S	*	.	H	α-helix	trans	-63.9	-38.2	178.5	-171.9	176.2	-178.1	178.5	0	112	F718 H719 L720 H725 N726	F718-K722 WeakPolarHBondContact O-CB 3.36Å; F718-K722 PolarHBondContact O-N 2.83Å; H719-K722 PolarHBondContact O-N 3.25Å; L720-K722 VanDerWaalsContact C-N 3.33Å; L720-K722 PolarHBondContact O-N 3.46Å; K722-H725 PolarHBondContact O-N 3.48Å; K722-N726 WeakPolarHBondContact O-CB 3.26Å; K722-N726 VanDerWaalsContact O-CG 3.25Å; K722-N726 PolarHBondContact O-N 3.36Å; K722-N726 PolarHBondContact O-OD1 3.45Å
723	Q	76.2	Confident	75.1	Confident	106 Å²	106	75.6 Å²	75.6	50%	0.495	38%	0.378	S	S	.	.	H	α-helix	trans	-64.5	-44.7	173.4	-74.1	177.1	-49.1	0	0	111.8	H719 L720 L721 N726 H727	H719-Q723 VanDerWaalsContact CE1-CD 3.48Å; H719-Q723 PolarHBondContact CE1-NE2 2.85Å; H719-Q723 PolarHBondContact ND1-OE1 3.47Å; H719-Q723 WeakPolarHBondContact O-CG 3.37Å; H719-Q723 PolarHBondContact O-N 2.77Å; L720-Q723 PolarHBondContact O-N 2.96Å; L721-Q723 VanDerWaalsContact C-N 3.34Å; L721-Q723 PolarHBondContact O-N 3.27Å; Q723-N726 PolarHBondContact O-N 2.93Å; Q723-H727 PolarHBondContact O-N 3.24Å
724	S	71.5	Confident	74.8	Confident	61 Å²	61	77.3 Å²	77.3	43%	0.427	38%	0.383	S	S	.	.	H	α-helix	trans	-60.7	-45.4	174.3	-59.3	0	0	0	0	111.8	L720 L721 N726 H727 L728	L720-S724 PolarHBondContact O-N 2.97Å; L720-S724 PolarHBondContact O-OG 3Å; L721-S724 PolarHBondContact O-N 2.88Å; S724-N726 PolarHBondContact O-N 3.37Å; S724-H727 PolarHBondContact O-N 3.49Å; S724-L728 VanDerWaalsContact O-CG 3.29Å; S724-L728 WeakPolarHBondContact O-CG 3.34Å; S724-L728 PolarHBondContact O-N 3.39Å
725	H	74.4	Confident	74.3	Confident	60 Å²	60	78 Å²	78	28%	0.278	39%	0.387	S	S	.	.	H	α-helix	trans	-60.2	-43.7	176.2	177.6	88.3	0	0	0	112.5	L721 K722 H727 L728 M729	L721-H725 WeakPolarHBondContact O-CB 3.37Å; L721-H725 PolarHBondContact O-N 2.89Å; K722-H725 PolarHBondContact O-N 3.48Å; H725-H727 VanDerWaalsContact C-N 3.34Å; H725-H727 PolarHBondContact O-N 2.91Å; H725-L728 WeakPolarHBondContact O-CB 3.5Å; H725-L728 PolarHBondContact O-N 3.45Å; H725-M729 PolarHBondContact O-N 3.23Å
726	N	77.4	Confident	74	Confident	80 Å²	80	80.4 Å²	80.4	43%	0.428	39%	0.394	S	S	.	.	H	α-helix	trans	-64.1	-38.6	176.3	-73.5	-3.6	0	0	0	112.2	K722 Q723 S724 M729 N730	K722-N726 WeakPolarHBondContact O-CB 3.26Å; K722-N726 VanDerWaalsContact O-CG 3.25Å; K722-N726 PolarHBondContact O-N 3.36Å; K722-N726 PolarHBondContact O-OD1 3.45Å; Q723-N726 PolarHBondContact O-N 2.93Å; S724-N726 PolarHBondContact O-N 3.37Å; N726-M729 PolarHBondContact O-N 3.22Å; N726-N730 WeakPolarHBondContact O-CB 3.48Å; N726-N730 VanDerWaalsContact O-CG 3.26Å; N726-N730 PolarHBondContact O-N 3.11Å; N726-N730 PolarHBondContact O-ND2 3.43Å
727	H	76.5	Confident	73.7	Confident	100 Å²	100	77.1 Å²	77.1	46%	0.463	39%	0.386	S	S	.	.	H	α-helix	trans	-62.4	-47.9	174.2	178.3	35.7	0	0	0	111.1	Q723 S724 H725 M729 N730 E731	Q723-H727 PolarHBondContact O-N 3.24Å; S724-H727 PolarHBondContact O-N 3.49Å; H725-H727 VanDerWaalsContact C-N 3.34Å; H725-H727 PolarHBondContact O-N 2.91Å; H727-M729 VanDerWaalsContact C-N 3.35Å; H727-M729 PolarHBondContact O-N 3.21Å; H727-N730 WeakPolarHBondContact O-CB 3.19Å; H727-N730 PolarHBondContact O-N 3.48Å; H727-N730 VanDerWaalsContact O-N 3.14Å; H727-E731 IonicContact CE1-OE1 2.67Å; H727-E731 PolarHBondContact CE1-OE1 2.93Å; H727-E731 VanDerWaalsContact CE1-OE1 3.27Å; H727-E731 IonicContact ND1-OE1 2.75Å; H727-E731 WeakPolarHBondContact O-CG 3.35Å; H727-E731 PolarHBondContact O-N 2.87Å
728	L	70	Confident	73.5	Confident	34 Å²	34	78.9 Å²	78.9	18%	0.178	40%	0.396	C	S	.	.	H	α-helix	trans	-55.7	-46.2	174.9	-70.3	173.7	0	0	0	112.9	S724 H725 N730 E731 L732 E766 T770	S724-L728 VanDerWaalsContact O-CG 3.29Å; S724-L728 WeakPolarHBondContact O-CG 3.34Å; S724-L728 PolarHBondContact O-N 3.39Å; H725-L728 WeakPolarHBondContact O-CB 3.5Å; H725-L728 PolarHBondContact O-N 3.45Å; L728-N730 VanDerWaalsContact C-N 3.29Å; L728-N730 PolarHBondContact O-N 2.77Å; L728-E731 PolarHBondContact O-N 3.17Å; L728-L732 WeakPolarHBondContact O-CB 3.32Å; L728-L732 PolarHBondContact O-N 3.47Å; L728-E766 HydrophobicContact CD2-CB 3.42Å; L728-E766 VanDerWaalsContact CD2-CB 3.42Å; L728-E766 HydrophobicContact CD2-CG 3.43Å; L728-E766 VanDerWaalsContact CD2-CG 3.43Å; L728-E766 VanDerWaalsContact CD2-OE2 3.26Å; L728-E766 WeakPolarHBondContact CD2-OE2 3.48Å; L728-T770 WeakPolarHBondContact CD1-OG1 3.39Å
729	M	72.8	Confident	72.8	Confident	50 Å²	50	78.7 Å²	78.7	25%	0.246	40%	0.395	C	S	.	.	H	α-helix	trans	-66.7	-33.5	-180	-164.2	68.1	-152.8	0	0	111.5	H725 N726 H727 L732 N733 K915	H725-M729 PolarHBondContact O-N 3.23Å; N726-M729 PolarHBondContact O-N 3.22Å; H727-M729 VanDerWaalsContact C-N 3.35Å; H727-M729 PolarHBondContact O-N 3.21Å; M729-L732 HydrophobicContact CE-CD2 4.43Å; M729-L732 HydrophobicContact SD-CD2 4.3Å; M729-N733 VanDerWaalsContact O-CB 3.29Å; M729-N733 WeakPolarHBondContact O-CB 3.41Å; M729-N733 PolarHBondContact O-N 2.83Å; M729-N733 PolarHBondContact O-ND2 2.89Å; M729-N733 VanDerWaalsContact O-ND2 3.12Å; M729-K915 PolarHBondContact SD-NZ 2.94Å
730	N	76.9	Confident	72.2	Confident	94 Å²	94	77.4 Å²	77.4	50%	0.503	39%	0.391	S	S	.	.	H	α-helix	trans	-68.8	-45	173.7	-74	-15.9	0	0	0	112.4	N726 H727 L728 L732 N733 Q734	N726-N730 WeakPolarHBondContact O-CB 3.48Å; N726-N730 VanDerWaalsContact O-CG 3.26Å; N726-N730 PolarHBondContact O-N 3.11Å; N726-N730 PolarHBondContact O-ND2 3.43Å; H727-N730 WeakPolarHBondContact O-CB 3.19Å; H727-N730 PolarHBondContact O-N 3.48Å; H727-N730 VanDerWaalsContact O-N 3.14Å; L728-N730 VanDerWaalsContact C-N 3.29Å; L728-N730 PolarHBondContact O-N 2.77Å; N730-L732 VanDerWaalsContact C-N 3.34Å; N730-L732 PolarHBondContact O-N 3.33Å; N730-N733 PolarHBondContact O-N 3.01Å; N730-Q734 WeakPolarHBondContact O-CG 3.49Å; N730-Q734 PolarHBondContact O-N 2.78Å
731	E	72.2	Confident	71.7	Confident	82 Å²	82	77.1 Å²	77.1	38%	0.383	39%	0.39	S	S	.	.	H	α-helix	trans	-59.1	-45.5	174.2	-67.1	-60.9	132.9	0	0	111.1	H727 L728 N733 Q734 L735	H727-E731 IonicContact CE1-OE1 2.67Å; H727-E731 PolarHBondContact CE1-OE1 2.93Å; H727-E731 VanDerWaalsContact CE1-OE1 3.27Å; H727-E731 IonicContact ND1-OE1 2.75Å; H727-E731 WeakPolarHBondContact O-CG 3.35Å; H727-E731 PolarHBondContact O-N 2.87Å; L728-E731 PolarHBondContact O-N 3.17Å; E731-N733 PolarHBondContact O-N 3.35Å; E731-Q734 PolarHBondContact O-N 3.35Å; E731-L735 WeakPolarHBondContact O-CB 3.38Å; E731-L735 PolarHBondContact O-N 3.49Å
732	L	71.5	Confident	71	Confident	59 Å²	59	78.4 Å²	78.4	31%	0.309	40%	0.397	S	S	.	.	H	α-helix	trans	-62	-41.6	176.9	-174.3	66.3	0	0	0	112.1	L728 M729 N730 K736	L728-L732 WeakPolarHBondContact O-CB 3.32Å; L728-L732 PolarHBondContact O-N 3.47Å; M729-L732 HydrophobicContact CE-CD2 4.43Å; M729-L732 HydrophobicContact SD-CD2 4.3Å; N730-L732 VanDerWaalsContact C-N 3.34Å; N730-L732 PolarHBondContact O-N 3.33Å; L732-K736 WeakPolarHBondContact O-CB 3.44Å; L732-K736 PolarHBondContact O-N 2.89Å
733	N	74.4	Confident	70	Confident	79 Å²	79	78.3 Å²	78.3	42%	0.422	40%	0.399	S	S	.	.	H	α-helix	trans	-68.3	-42.6	177	-77.7	-28.4	0	0	0	112.5	M729 N730 E731 L735 K736 G737	M729-N733 VanDerWaalsContact O-CB 3.29Å; M729-N733 WeakPolarHBondContact O-CB 3.41Å; M729-N733 PolarHBondContact O-N 2.83Å; M729-N733 PolarHBondContact O-ND2 2.89Å; M729-N733 VanDerWaalsContact O-ND2 3.12Å; N730-N733 PolarHBondContact O-N 3.01Å; E731-N733 PolarHBondContact O-N 3.35Å; N733-L735 VanDerWaalsContact C-N 3.34Å; N733-K736 PolarHBondContact O-N 3.13Å; N733-G737 PolarHBondContact O-N 3.39Å
734	Q	73.3	Confident	69.1	Low	117 Å²	117	80.8 Å²	80.8	55%	0.547	41%	0.408	S	S	.	.	H	α-helix	trans	-59.5	-46.8	174.1	-76.3	-175.1	29.2	0	0	110.7	N730 E731 G737 N738	N730-Q734 WeakPolarHBondContact O-CG 3.49Å; N730-Q734 PolarHBondContact O-N 2.78Å; E731-Q734 PolarHBondContact O-N 3.35Å; Q734-G737 CarbonylContact O-C 3.57Å; Q734-G737 WeakPolarHBondContact O-CA 3.26Å; Q734-G737 PolarHBondContact O-N 3.34Å; Q734-G737 VanDerWaalsContact O-N 3.16Å; Q734-N738 PolarHBondContact O-N 2.98Å
735	L	63.5	Low	68.2	Low	46 Å²	46	80.8 Å²	80.8	24%	0.241	41%	0.408	C	S	.	.	H	α-helix	trans	-65.2	-41.5	178.3	-169.4	89	0	0	0	112.1	E731 N733 G737 N738 F739 F759	E731-L735 WeakPolarHBondContact O-CB 3.38Å; E731-L735 PolarHBondContact O-N 3.49Å; N733-L735 VanDerWaalsContact C-N 3.34Å; L735-G737 PolarHBondContact O-N 3.39Å; L735-N738 CarbonylContact O-C 3.6Å; L735-N738 WeakPolarHBondContact O-CA 3.36Å; L735-N738 WeakPolarHBondContact O-CB 3.5Å; L735-N738 PolarHBondContact O-N 2.88Å; L735-F739 PolarHBondContact O-N 3.02Å; L735-F759 HydrophobicContact CD1-CD2 4.45Å; L735-F759 HydrophobicContact CD2-CD1 4.17Å; L735-F759 HydrophobicContact CD2-CD2 3.09Å; L735-F759 HydrophobicContact CD2-CE1 4.07Å; L735-F759 HydrophobicContact CD2-CE2 2.95Å; L735-F759 HydrophobicContact CD2-CG 3.71Å; L735-F759 HydrophobicContact CD2-CZ 3.46Å; L735-F759 VanDerWaalsContact CD2-CZ 3.46Å; L735-F759 HydrophobicContact CG-CD2 4.36Å; L735-F759 HydrophobicContact CG-CE2 4.43Å
736	K	70.6	Confident	67	Low	138 Å²	138	87.5 Å²	87.5	60%	0.6	44%	0.437	S	S	*	.	H	α-helix	trans	-55.3	-41.4	173.1	-175	172.7	-178.6	172.4	0	110.9	L732 N733 F739 L740	L732-K736 WeakPolarHBondContact O-CB 3.44Å; L732-K736 PolarHBondContact O-N 2.89Å; N733-K736 PolarHBondContact O-N 3.13Å; K736-F739 PolarHBondContact O-N 3.48Å; K736-L740 HydrophobicContact CG-CD1 4.27Å; K736-L740 WeakPolarHBondContact O-CB 3.48Å; K736-L740 PolarHBondContact O-N 2.88Å
737	G	71.9	Confident	65.5	Low	29 Å²	29	90.1 Å²	90.1	30%	0.299	45%	0.451	S	S	.	.	H	α-helix	trans	-61.3	-46.8	171.1	0	0	0	0	0	113.4	N733 Q734 L735 F739 L740 N741	N733-G737 PolarHBondContact O-N 3.39Å; Q734-G737 CarbonylContact O-C 3.57Å; Q734-G737 WeakPolarHBondContact O-CA 3.26Å; Q734-G737 PolarHBondContact O-N 3.34Å; Q734-G737 VanDerWaalsContact O-N 3.16Å; L735-G737 PolarHBondContact O-N 3.39Å; G737-F739 PolarHBondContact O-N 3.31Å; G737-L740 PolarHBondContact O-N 3.41Å; G737-N741 PolarHBondContact O-N 2.97Å; G737-N741 PolarHBondContact O-ND2 3.24Å
738	N	71.8	Confident	64.3	Low	89 Å²	89	92.2 Å²	92.2	48%	0.476	46%	0.461	S	S	.	.	H	α-helix	trans	-61.8	-40.7	177	-67.5	-19.7	0	0	0	112.1	Q734 L735 N741 L742	Q734-N738 PolarHBondContact O-N 2.98Å; L735-N738 CarbonylContact O-C 3.6Å; L735-N738 WeakPolarHBondContact O-CA 3.36Å; L735-N738 WeakPolarHBondContact O-CB 3.5Å; L735-N738 PolarHBondContact O-N 2.88Å; N738-N741 PolarHBondContact O-N 3.42Å; N738-L742 WeakPolarHBondContact O-CB 3.44Å; N738-L742 PolarHBondContact O-N 2.94Å
739	F	59	Low	63.6	Low	59 Å²	59	96 Å²	96	26%	0.259	48%	0.481	S	S	.	.	H	α-helix	trans	-66.7	-40.5	177.2	-132	-85.8	0	0	0	111.9	L735 K736 G737 N741 L742 Q743 F926	L735-F739 PolarHBondContact O-N 3.02Å; K736-F739 PolarHBondContact O-N 3.48Å; G737-F739 PolarHBondContact O-N 3.31Å; F739-N741 VanDerWaalsContact C-N 3.27Å; F739-N741 PolarHBondContact O-N 2.81Å; F739-L742 PolarHBondContact O-N 3.46Å; F739-Q743 PolarHBondContact O-N 2.99Å; F739-F926 HydrophobicContact CE1-CD2 4.38Å; F739-F926 AromaticContact CE1-CE2 3.92Å; F739-F926 HydrophobicContact CE1-CE2 3.92Å; F739-F926 HydrophobicContact CE1-CZ 4.3Å
740	L	65	Low	62.7	Low	86 Å²	86	99.8 Å²	99.8	45%	0.45	50%	0.502	S	S	.	.	H	α-helix	trans	-63.3	-30.3	171.9	-92.9	151.5	0	0	0	113	K736 G737	K736-L740 HydrophobicContact CG-CD1 4.27Å; K736-L740 WeakPolarHBondContact O-CB 3.48Å; K736-L740 PolarHBondContact O-N 2.88Å; G737-L740 PolarHBondContact O-N 3.41Å
741	N	65.5	Low	61.8	Low	91 Å²	91	99.7 Å²	99.7	49%	0.487	50%	0.502	S	S	.	.	H	α-helix	trans	-77.1	-41.8	172.5	-69.6	-25.6	0	0	0	111.6	G737 N738 F739 Q743 K744 S745	G737-N741 PolarHBondContact O-N 2.97Å; G737-N741 PolarHBondContact O-ND2 3.24Å; N738-N741 PolarHBondContact O-N 3.42Å; F739-N741 VanDerWaalsContact C-N 3.27Å; F739-N741 PolarHBondContact O-N 2.81Å; N741-Q743 PolarHBondContact O-N 3.13Å; N741-K744 WeakPolarHBondContact O-CA 3.24Å; N741-K744 WeakPolarHBondContact O-CB 3.46Å; N741-K744 PolarHBondContact O-N 2.96Å; N741-S745 PolarHBondContact O-N 3.2Å
742	L	58.7	Low	60.9	Low	49 Å²	49	99.9 Å²	99.9	26%	0.257	50%	0.499	S	S	.	.	H	α-helix	trans	-60.4	-30.5	173.4	-103.7	148	0	0	0	113	N738 F739 K744 S745 R752	N738-L742 WeakPolarHBondContact O-CB 3.44Å; N738-L742 PolarHBondContact O-N 2.94Å; F739-L742 PolarHBondContact O-N 3.46Å; L742-K744 PolarHBondContact O-N 3.41Å; L742-S745 WeakPolarHBondContact CA-OG 3.39Å; L742-S745 PolarHBondContact O-OG 3.33Å; L742-S745 VanDerWaalsContact O-OG 3.05Å; L742-R752 HydrophobicContact CD2-CG 4.18Å
743	Q	56.6	Low	60.3	Low	135 Å²	135	102.2 Å²	102.2	63%	0.631	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.6	-21.9	173.6	-161.4	178.4	23.4	0	0	112.9	F739 N741	F739-Q743 PolarHBondContact O-N 2.99Å; N741-Q743 PolarHBondContact O-N 3.13Å
744	K	57.2	Low	59.5	Low	158 Å²	158	103 Å²	103	69%	0.687	52%	0.515	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87	-32.8	175.7	-62.4	169.4	-173.6	168.8	0	112.2	N741 L742 K746	N741-K744 WeakPolarHBondContact O-CA 3.24Å; N741-K744 WeakPolarHBondContact O-CB 3.46Å; N741-K744 PolarHBondContact O-N 2.96Å; L742-K744 PolarHBondContact O-N 3.41Å; K744-K746 PolarHBondContact O-N 3.33Å; K744-K746 VanDerWaalsContact O-N 3.14Å
745	S	52.2	Low	59	Low	62 Å²	62	102.1 Å²	102.1	43%	0.434	51%	0.511	S	S	.	.			trans	-76.8	94.3	173.1	55.2	0	0	0	0	110.5	N741 L742 N747	N741-S745 PolarHBondContact O-N 3.2Å; L742-S745 WeakPolarHBondContact CA-OG 3.39Å; L742-S745 PolarHBondContact O-OG 3.33Å; L742-S745 VanDerWaalsContact O-OG 3.05Å; S745-N747 VanDerWaalsContact C-N 3.27Å; S745-N747 PolarHBondContact O-N 2.92Å
746	K	50	Low	58.7	Low	200 Å²	200	101.7 Å²	101.7	87%	0.87	51%	0.508	S	S	*	.			trans	-80.4	5.4	-167.9	-135.3	178.1	-174.8	-179.1	0	116	K744	K744-K746 PolarHBondContact O-N 3.33Å; K744-K746 VanDerWaalsContact O-N 3.14Å
747	N	45.3	Very low	58.2	Low	136 Å²	136	100.9 Å²	100.9	73%	0.727	51%	0.507	S	S	*	.			trans	-129.1	151	-177.1	-67.7	-21.5	0	0	0	109.9	S745	S745-N747 VanDerWaalsContact C-N 3.27Å; S745-N747 PolarHBondContact O-N 2.92Å
748	E	52	Low	58	Low	144 Å²	144	105.1 Å²	105.1	67%	0.673	52%	0.517	S	S	*	.			trans	91.6	93.1	179.3	-62.3	164.9	-173.9	0	0	115.4	R752	E748-R752 VanDerWaalsContact O-CD 3.3Å; E748-R752 WeakPolarHBondContact O-CD 3.35Å; E748-R752 WeakPolarHBondContact O-CG 3.13Å
749	N	55.2	Low	57.4	Low	112 Å²	112	101.6 Å²	101.6	60%	0.599	50%	0.497	S	S	*	.	H	α-helix	trans	-83.9	-15.4	179.5	-82.6	-21.5	0	0	0	114.7	R752	N749-R752 PolarHBondContact OD1-NH1 3.49Å; N749-R752 VanDerWaalsContact OD1-NH1 3.14Å
750	N	53.8	Low	57.6	Low	131 Å²	131	103.9 Å²	103.9	70%	0.701	51%	0.511	S	S	*	.	H	α-helix	trans	-80.2	-48.8	-177.5	-73.9	3.8	0	0	0	111.8	R752 I753	N750-R752 PolarHBondContact O-N 3.17Å; N750-R752 VanDerWaalsContact O-N 3.1Å; N750-I753 PolarHBondContact O-N 2.75Å
751	D	57.4	Low	57.6	Low	91 Å²	91	104.5 Å²	104.5	49%	0.487	51%	0.514	S	S	.	.	H	α-helix	trans	-57.8	-27.9	176.3	-74	30.8	0	0	0	112.6	I753 H755	D751-I753 VanDerWaalsContact C-N 3.33Å; D751-I753 PolarHBondContact O-N 3.13Å; D751-H755 WeakPolarHBondContact O-CB 3.46Å; D751-H755 PolarHBondContact O-CD2 3.27Å; D751-H755 PolarHBondContact O-N 3.37Å
752	R	54.1	Low	57.7	Low	86 Å²	86	104.5 Å²	104.5	33%	0.325	51%	0.514	S	S	.	.	H	α-helix	trans	-62.1	-36.7	176	-67.9	171.2	113.6	-162.6	-0.3	112.9	L742 E748 N749 N750 L756	L742-R752 HydrophobicContact CD2-CG 4.18Å; E748-R752 VanDerWaalsContact O-CD 3.3Å; E748-R752 WeakPolarHBondContact O-CD 3.35Å; E748-R752 WeakPolarHBondContact O-CG 3.13Å; N749-R752 PolarHBondContact OD1-NH1 3.49Å; N749-R752 VanDerWaalsContact OD1-NH1 3.14Å; N750-R752 PolarHBondContact O-N 3.17Å; N750-R752 VanDerWaalsContact O-N 3.1Å; R752-L756 WeakPolarHBondContact O-CB 3.48Å; R752-L756 PolarHBondContact O-N 2.99Å; R752-L756 VanDerWaalsContact O-N 3.11Å
753	I	58.9	Low	57.8	Low	109 Å²	109	104 Å²	104	56%	0.559	51%	0.511	S	S	*	.	H	α-helix	trans	-74.7	-48.5	-178.6	-62.8	177.6	0	0	0	109.9	N750 D751 H755 L756 E757	N750-I753 PolarHBondContact O-N 2.75Å; D751-I753 VanDerWaalsContact C-N 3.33Å; D751-I753 PolarHBondContact O-N 3.13Å; I753-H755 VanDerWaalsContact C-N 3.28Å; I753-H755 PolarHBondContact O-N 3.08Å; I753-L756 WeakPolarHBondContact O-CB 3.45Å; I753-L756 PolarHBondContact O-N 3.18Å; I753-L756 VanDerWaalsContact O-N 3.08Å; I753-E757 PolarHBondContact O-N 3.31Å
754	D	58.4	Low	58	Low	94 Å²	94	99.5 Å²	99.5	50%	0.503	50%	0.497	S	S	.	.	H	α-helix	trans	-58.5	-38.1	176.3	-90.6	32.4	0	0	0	112.6	K758	D754-K758 WeakPolarHBondContact O-CB 3.35Å; D754-K758 WeakPolarHBondContact O-CG 3.48Å; D754-K758 PolarHBondContact O-N 3.49Å; D754-K758 VanDerWaalsContact O-N 3.09Å
755	H	61.1	Low	58.4	Low	100 Å²	100	96.5 Å²	96.5	46%	0.463	49%	0.488	S	S	.	.	H	α-helix	trans	-70.2	-37.3	174.7	-80.5	-54.6	0	0	0	112.9	D751 I753 F759	D751-H755 WeakPolarHBondContact O-CB 3.46Å; D751-H755 PolarHBondContact O-CD2 3.27Å; D751-H755 PolarHBondContact O-N 3.37Å; I753-H755 VanDerWaalsContact C-N 3.28Å; I753-H755 PolarHBondContact O-N 3.08Å; H755-F759 VanDerWaalsContact O-CB 3.25Å; H755-F759 WeakPolarHBondContact O-CB 3.49Å; H755-F759 PolarHBondContact O-N 2.85Å
756	L	58.8	Low	58.7	Low	37 Å²	37	95.4 Å²	95.4	19%	0.194	48%	0.476	C	S	.	.	H	α-helix	trans	-66.3	-42.4	174.2	-95.7	157.8	0	0	0	112.1	R752 I753 F759 I760	R752-L756 WeakPolarHBondContact O-CB 3.48Å; R752-L756 PolarHBondContact O-N 2.99Å; R752-L756 VanDerWaalsContact O-N 3.11Å; I753-L756 WeakPolarHBondContact O-CB 3.45Å; I753-L756 PolarHBondContact O-N 3.18Å; I753-L756 VanDerWaalsContact O-N 3.08Å; L756-F759 WeakPolarHBondContact O-CB 3.49Å; L756-F759 PolarHBondContact O-N 3.31Å; L756-I760 VanDerWaalsContact O-CG1 3.32Å; L756-I760 WeakPolarHBondContact O-CG1 2.85Å; L756-I760 PolarHBondContact O-N 3.5Å
757	E	60.2	Low	59.1	Low	120 Å²	120	88.3 Å²	88.3	56%	0.561	45%	0.447	S	S	*	.	H	α-helix	trans	-67.2	-45	178.8	-170.4	171.8	-163.5	0	0	111.6	I753 F759 I760 L761	I753-E757 PolarHBondContact O-N 3.31Å; E757-F759 VanDerWaalsContact C-N 3.28Å; E757-F759 PolarHBondContact O-N 3.33Å; E757-I760 PolarHBondContact O-N 2.86Å; E757-L761 HydrophobicContact CG-CD1 4.32Å; E757-L761 WeakPolarHBondContact O-CG 3.34Å; E757-L761 PolarHBondContact O-N 3.42Å
758	K	66.8	Low	60.2	Low	118 Å²	118	85.8 Å²	85.8	51%	0.513	43%	0.433	S	S	.	.	H	α-helix	trans	-58	-40.2	171.3	-77.8	170	-178.2	154.3	0	112	D754 L761 I762	D754-K758 WeakPolarHBondContact O-CB 3.35Å; D754-K758 WeakPolarHBondContact O-CG 3.48Å; D754-K758 PolarHBondContact O-N 3.49Å; D754-K758 VanDerWaalsContact O-N 3.09Å; K758-L761 PolarHBondContact O-N 2.92Å; K758-I762 WeakPolarHBondContact O-CD1 3.38Å; K758-I762 VanDerWaalsContact O-CG1 3.26Å; K758-I762 WeakPolarHBondContact O-CG1 3.42Å; K758-I762 PolarHBondContact O-N 2.91Å
759	F	59.1	Low	60.8	Low	16 Å²	16	84.1 Å²	84.1	7%	0.07	42%	0.424	C	S	.	.	H	α-helix	trans	-64.2	-47.7	177.6	171	-139.3	0	0	0	112.5	L735 H755 L756 E757 L761 I762 L763 L919	L735-F759 HydrophobicContact CD1-CD2 4.45Å; L735-F759 HydrophobicContact CD2-CD1 4.17Å; L735-F759 HydrophobicContact CD2-CD2 3.09Å; L735-F759 HydrophobicContact CD2-CE1 4.07Å; L735-F759 HydrophobicContact CD2-CE2 2.95Å; L735-F759 HydrophobicContact CD2-CG 3.71Å; L735-F759 HydrophobicContact CD2-CZ 3.46Å; L735-F759 VanDerWaalsContact CD2-CZ 3.46Å; L735-F759 HydrophobicContact CG-CD2 4.36Å; L735-F759 HydrophobicContact CG-CE2 4.43Å; H755-F759 VanDerWaalsContact O-CB 3.25Å; H755-F759 WeakPolarHBondContact O-CB 3.49Å; H755-F759 PolarHBondContact O-N 2.85Å; L756-F759 WeakPolarHBondContact O-CB 3.49Å; L756-F759 PolarHBondContact O-N 3.31Å; E757-F759 VanDerWaalsContact C-N 3.28Å; E757-F759 PolarHBondContact O-N 3.33Å; F759-L761 VanDerWaalsContact C-N 3.27Å; F759-L761 PolarHBondContact O-N 3.36Å; F759-I762 PolarHBondContact O-N 3.44Å; F759-L763 HydrophobicContact CD2-CD1 3.88Å; F759-L763 HydrophobicContact CD2-CG 3.85Å; F759-L763 HydrophobicContact CE1-CD1 3.97Å; F759-L763 HydrophobicContact CE2-CD1 3.18Å; F759-L763 HydrophobicContact CE2-CD2 4.01Å; F759-L763 HydrophobicContact CE2-CG 3.35Å; F759-L763 HydrophobicContact CZ-CD1 3.28Å; F759-L763 HydrophobicContact CZ-CG 4Å; F759-L763 PolarHBondContact O-N 2.94Å; F759-L919 HydrophobicContact CE1-CD1 3.94Å; F759-L919 HydrophobicContact CE1-CD2 4.05Å; F759-L919 HydrophobicContact CE1-CG 4.4Å; F759-L919 HydrophobicContact CZ-CD1 3.63Å; F759-L919 HydrophobicContact CZ-CD2 3.62Å; F759-L919 HydrophobicContact CZ-CG 4.18Å
760	I	63.5	Low	60.9	Low	107 Å²	107	80.1 Å²	80.1	55%	0.549	40%	0.403	S	S	.	.	H	α-helix	trans	-58.9	-41.6	177	-69.1	164.7	0	0	0	110.4	L756 E757 A764	L756-I760 VanDerWaalsContact O-CG1 3.32Å; L756-I760 WeakPolarHBondContact O-CG1 2.85Å; L756-I760 PolarHBondContact O-N 3.5Å; E757-I760 PolarHBondContact O-N 2.86Å; I760-A764 VanDerWaalsContact O-CB 3.26Å; I760-A764 WeakPolarHBondContact O-CB 3.12Å; I760-A764 PolarHBondContact O-N 3Å
761	L	65.9	Low	61.3	Low	99 Å²	99	78 Å²	78	52%	0.518	39%	0.391	S	S	.	.	H	α-helix	trans	-66.4	-39	176.5	-74.9	166.6	0	0	0	113.6	E757 K758 F759 N765	E757-L761 HydrophobicContact CG-CD1 4.32Å; E757-L761 WeakPolarHBondContact O-CG 3.34Å; E757-L761 PolarHBondContact O-N 3.42Å; K758-L761 PolarHBondContact O-N 2.92Å; F759-L761 VanDerWaalsContact C-N 3.27Å; F759-L761 PolarHBondContact O-N 3.36Å; L761-N765 WeakPolarHBondContact O-CB 3.35Å; L761-N765 PolarHBondContact O-N 2.98Å; L761-N765 VanDerWaalsContact O-N 3.12Å; L761-N765 PolarHBondContact O-ND2 3.3Å
762	I	65.9	Low	61.6	Low	91 Å²	91	80 Å²	80	47%	0.467	40%	0.395	S	S	.	.	H	α-helix	trans	-65.4	-50.1	175.3	-71.1	163.8	0	0	0	109.9	K758 F759 A764 N765 E766	K758-I762 WeakPolarHBondContact O-CD1 3.38Å; K758-I762 VanDerWaalsContact O-CG1 3.26Å; K758-I762 WeakPolarHBondContact O-CG1 3.42Å; K758-I762 PolarHBondContact O-N 2.91Å; F759-I762 PolarHBondContact O-N 3.44Å; I762-A764 PolarHBondContact O-N 3.35Å; I762-N765 PolarHBondContact O-N 3.41Å; I762-E766 PolarHBondContact O-N 2.94Å
763	L	60.4	Low	61.7	Low	38 Å²	38	77.8 Å²	77.8	20%	0.199	39%	0.391	C	S	.	.	H	α-helix	trans	-58.2	-45.7	176.9	-83.3	178.4	0	0	0	112.7	F759 N765 E766 L767 L919	F759-L763 HydrophobicContact CD2-CD1 3.88Å; F759-L763 HydrophobicContact CD2-CG 3.85Å; F759-L763 HydrophobicContact CE1-CD1 3.97Å; F759-L763 HydrophobicContact CE2-CD1 3.18Å; F759-L763 HydrophobicContact CE2-CD2 4.01Å; F759-L763 HydrophobicContact CE2-CG 3.35Å; F759-L763 HydrophobicContact CZ-CD1 3.28Å; F759-L763 HydrophobicContact CZ-CG 4Å; F759-L763 PolarHBondContact O-N 2.94Å; L763-N765 PolarHBondContact O-N 3.18Å; L763-E766 PolarHBondContact O-N 3.42Å; L763-L767 VanDerWaalsContact O-CB 3.28Å; L763-L767 WeakPolarHBondContact O-CB 3.32Å; L763-L767 PolarHBondContact O-N 3.39Å; L763-L919 HydrophobicContact CD1-CD2 3.36Å
764	A	61.1	Low	61.7	Low	41 Å²	41	74.9 Å²	74.9	34%	0.339	38%	0.376	S	S	.	.	H	α-helix	trans	-60.6	-44.8	179.6	0	0	0	0	0	111.5	I760 I762 I768	I760-A764 VanDerWaalsContact O-CB 3.26Å; I760-A764 WeakPolarHBondContact O-CB 3.12Å; I760-A764 PolarHBondContact O-N 3Å; I762-A764 PolarHBondContact O-N 3.35Å; A764-I768 WeakPolarHBondContact O-CB 3.45Å; A764-I768 WeakPolarHBondContact O-CD1 3.49Å; A764-I768 WeakPolarHBondContact O-CG1 3.5Å; A764-I768 PolarHBondContact O-N 3.29Å
765	N	65.3	Low	61.6	Low	94 Å²	94	77.1 Å²	77.1	50%	0.503	38%	0.379	S	S	.	.	H	α-helix	trans	-64	-41	177.6	-82.1	-51.2	0	0	0	112.8	L761 I762 L763 I768 K769	L761-N765 WeakPolarHBondContact O-CB 3.35Å; L761-N765 PolarHBondContact O-N 2.98Å; L761-N765 VanDerWaalsContact O-N 3.12Å; L761-N765 PolarHBondContact O-ND2 3.3Å; I762-N765 PolarHBondContact O-N 3.41Å; L763-N765 PolarHBondContact O-N 3.18Å; N765-I768 PolarHBondContact O-N 3.13Å; N765-K769 PolarHBondContact O-N 3.06Å
766	E	58.8	Low	61.5	Low	40 Å²	40	78 Å²	78	19%	0.187	38%	0.383	C	S	.	.	H	α-helix	trans	-74.5	-34.6	179.2	-72.9	-42.2	132.5	0	0	113.4	L728 I762 L763 K769 T770	L728-E766 HydrophobicContact CD2-CB 3.42Å; L728-E766 VanDerWaalsContact CD2-CB 3.42Å; L728-E766 HydrophobicContact CD2-CG 3.43Å; L728-E766 VanDerWaalsContact CD2-CG 3.43Å; L728-E766 VanDerWaalsContact CD2-OE2 3.26Å; L728-E766 WeakPolarHBondContact CD2-OE2 3.48Å; I762-E766 PolarHBondContact O-N 2.94Å; L763-E766 PolarHBondContact O-N 3.42Å; E766-K769 PolarHBondContact O-N 2.97Å; E766-K769 WeakPolarHBondContact OE1-CD 3.4Å; E766-K769 WeakPolarHBondContact OE1-CE 3.49Å; E766-K769 IonicContact OE1-NZ 2.62Å; E766-K769 PolarHBondContact OE1-NZ 3.19Å; E766-K769 WeakPolarHBondContact OE2-CD 3.45Å; E766-K769 IonicContact OE2-NZ 3.51Å; E766-T770 WeakPolarHBondContact O-CB 3.25Å; E766-T770 PolarHBondContact O-N 2.9Å; E766-T770 PolarHBondContact O-OG1 3.45Å
767	L	60.1	Low	61.4	Low	50 Å²	50	77.5 Å²	77.5	26%	0.262	38%	0.381	S	S	.	.	H	α-helix	trans	-57.2	-48.9	165.6	-98.7	159.6	0	0	0	110.8	L763 K769 T770 I771 F912 L916	L763-L767 VanDerWaalsContact O-CB 3.28Å; L763-L767 WeakPolarHBondContact O-CB 3.32Å; L763-L767 PolarHBondContact O-N 3.39Å; L767-K769 PolarHBondContact O-N 2.98Å; L767-T770 PolarHBondContact O-N 3.25Å; L767-I771 HydrophobicContact CD2-CD1 4.28Å; L767-I771 WeakPolarHBondContact O-CB 3.39Å; L767-I771 VanDerWaalsContact O-CG1 3.23Å; L767-I771 WeakPolarHBondContact O-CG1 3.25Å; L767-I771 PolarHBondContact O-N 3.03Å; L767-F912 HydrophobicContact CD2-CE1 3.57Å; L767-F912 HydrophobicContact CD2-CZ 3.82Å; L767-F912 HydrophobicContact CG-CE1 4.13Å; L767-F912 HydrophobicContact CG-CZ 3.96Å; L767-L916 HydrophobicContact CD1-CD1 4.42Å
768	I	66.8	Low	61.2	Low	83 Å²	83	79.5 Å²	79.5	43%	0.426	38%	0.383	S	S	.	.	H	α-helix	trans	-61.6	-41.4	179	-72.2	164.1	0	0	0	111.4	A764 N765 K772	A764-I768 WeakPolarHBondContact O-CB 3.45Å; A764-I768 WeakPolarHBondContact O-CD1 3.49Å; A764-I768 WeakPolarHBondContact O-CG1 3.5Å; A764-I768 PolarHBondContact O-N 3.29Å; N765-I768 PolarHBondContact O-N 3.13Å; I768-K772 HydrophobicContact CG2-CD 4.23Å; I768-K772 WeakPolarHBondContact O-CB 3.48Å; I768-K772 VanDerWaalsContact O-CG 3.29Å; I768-K772 WeakPolarHBondContact O-CG 3.28Å; I768-K772 PolarHBondContact O-N 3.27Å
769	K	65.2	Low	60.8	Low	110 Å²	110	78.6 Å²	78.6	48%	0.478	38%	0.384	S	S	.	.	H	α-helix	trans	-61.3	-51.4	173.1	-79.1	166.8	171.8	178.3	0	111.2	N765 E766 L767 I771 K772 T773	N765-K769 PolarHBondContact O-N 3.06Å; E766-K769 PolarHBondContact O-N 2.97Å; E766-K769 WeakPolarHBondContact OE1-CD 3.4Å; E766-K769 WeakPolarHBondContact OE1-CE 3.49Å; E766-K769 IonicContact OE1-NZ 2.62Å; E766-K769 PolarHBondContact OE1-NZ 3.19Å; E766-K769 WeakPolarHBondContact OE2-CD 3.45Å; E766-K769 IonicContact OE2-NZ 3.51Å; L767-K769 PolarHBondContact O-N 2.98Å; K769-I771 VanDerWaalsContact C-N 3.35Å; K769-I771 PolarHBondContact O-N 2.78Å; K769-K772 WeakPolarHBondContact O-CB 3.33Å; K769-K772 PolarHBondContact O-N 3.31Å; K769-K772 VanDerWaalsContact O-N 3.1Å; K769-T773 PolarHBondContact O-N 3.44Å; K769-T773 PolarHBondContact O-OG1 3.17Å; K769-T773 VanDerWaalsContact O-OG1 3.08Å
770	T	57.2	Low	60.5	Low	27 Å²	27	82.4 Å²	82.4	17%	0.166	40%	0.402	C	S	.	.	H	α-helix	trans	-58.4	-46.3	-178.8	-54.7	0	0	0	0	111.4	L728 E766 L767 K772 T773 I774	L728-T770 WeakPolarHBondContact CD1-OG1 3.39Å; E766-T770 WeakPolarHBondContact O-CB 3.25Å; E766-T770 PolarHBondContact O-N 2.9Å; E766-T770 PolarHBondContact O-OG1 3.45Å; L767-T770 PolarHBondContact O-N 3.25Å; T770-K772 PolarHBondContact O-N 3.1Å; T770-T773 PolarHBondContact O-N 3.37Å; T770-I774 HydrophobicContact CG2-CD1 3.96Å; T770-I774 VanDerWaalsContact O-CG1 3.3Å; T770-I774 WeakPolarHBondContact O-CG1 3.43Å; T770-I774 PolarHBondContact O-N 3.47Å
771	I	61.4	Low	59.8	Low	86 Å²	86	79.3 Å²	79.3	44%	0.441	39%	0.39	S	S	.	.	H	α-helix	trans	-61.5	-42.1	175.8	-68.6	165.4	0	0	0	111.3	L767 K769 I774 Y775	L767-I771 HydrophobicContact CD2-CD1 4.28Å; L767-I771 WeakPolarHBondContact O-CB 3.39Å; L767-I771 VanDerWaalsContact O-CG1 3.23Å; L767-I771 WeakPolarHBondContact O-CG1 3.25Å; L767-I771 PolarHBondContact O-N 3.03Å; K769-I771 VanDerWaalsContact C-N 3.35Å; K769-I771 PolarHBondContact O-N 2.78Å; I771-I774 PolarHBondContact O-N 3.11Å; I771-Y775 HydrophobicContact CG2-CD2 4.06Å; I771-Y775 HydrophobicContact CG2-CE2 4.42Å; I771-Y775 WeakPolarHBondContact O-CB 3.49Å; I771-Y775 PolarHBondContact O-N 3.14Å
772	K	63.7	Low	59.1	Low	134 Å²	134	78.1 Å²	78.1	58%	0.583	39%	0.389	S	S	*	.	H	α-helix	trans	-61	-45.2	175.4	-79.7	173.9	178.5	177	0	111.9	I768 K769 T770 Y775 Q776	I768-K772 HydrophobicContact CG2-CD 4.23Å; I768-K772 WeakPolarHBondContact O-CB 3.48Å; I768-K772 VanDerWaalsContact O-CG 3.29Å; I768-K772 WeakPolarHBondContact O-CG 3.28Å; I768-K772 PolarHBondContact O-N 3.27Å; K769-K772 WeakPolarHBondContact O-CB 3.33Å; K769-K772 PolarHBondContact O-N 3.31Å; K769-K772 VanDerWaalsContact O-N 3.1Å; T770-K772 PolarHBondContact O-N 3.1Å; K772-Y775 PolarHBondContact O-N 3.2Å; K772-Q776 WeakPolarHBondContact O-CG 3.5Å; K772-Q776 PolarHBondContact O-N 2.98Å
773	T	57.2	Low	58.3	Low	39 Å²	39	79.2 Å²	79.2	24%	0.239	39%	0.394	C	S	.	.	H	α-helix	trans	-66.9	-40.2	179.5	-45	0	0	0	0	111.5	L721 K769 T770 Y775 Q776 L777	L721-T773 HydrophobicContact CD1-CG2 3.63Å; K769-T773 PolarHBondContact O-N 3.44Å; K769-T773 PolarHBondContact O-OG1 3.17Å; K769-T773 VanDerWaalsContact O-OG1 3.08Å; T770-T773 PolarHBondContact O-N 3.37Å; T773-Y775 PolarHBondContact O-N 2.96Å; T773-Q776 PolarHBondContact O-N 3.41Å; T773-L777 HydrophobicContact CG2-CD1 4.28Å; T773-L777 WeakPolarHBondContact O-CG 3.43Å; T773-L777 PolarHBondContact O-N 3.4Å
774	I	58.5	Low	57.7	Low	48 Å²	48	79.8 Å²	79.8	25%	0.246	40%	0.397	C	S	.	.	H	α-helix	trans	-60.1	-43.9	172.8	-69.6	167.6	0	0	0	111	T770 I771 L777 R778 L905	T770-I774 HydrophobicContact CG2-CD1 3.96Å; T770-I774 VanDerWaalsContact O-CG1 3.3Å; T770-I774 WeakPolarHBondContact O-CG1 3.43Å; T770-I774 PolarHBondContact O-N 3.47Å; I771-I774 PolarHBondContact O-N 3.11Å; I774-L777 PolarHBondContact O-N 3.2Å; I774-R778 WeakPolarHBondContact O-CB 3.47Å; I774-R778 PolarHBondContact O-N 2.91Å; I774-L905 HydrophobicContact CG1-CD2 4.14Å; I774-L905 HydrophobicContact CG2-CD2 4.36Å
775	Y	56.9	Low	57.1	Low	141 Å²	141	80.8 Å²	80.8	55%	0.553	40%	0.398	S	S	*	.	H	α-helix	trans	-63.8	-39.5	176.4	-104.8	-82.3	0	0	0	113.1	I771 K772 T773 R778 N779	I771-Y775 HydrophobicContact CG2-CD2 4.06Å; I771-Y775 HydrophobicContact CG2-CE2 4.42Å; I771-Y775 WeakPolarHBondContact O-CB 3.49Å; I771-Y775 PolarHBondContact O-N 3.14Å; K772-Y775 PolarHBondContact O-N 3.2Å; T773-Y775 PolarHBondContact O-N 2.96Å; Y775-R778 PolarHBondContact O-N 3.22Å; Y775-N779 WeakPolarHBondContact O-CB 3.45Å; Y775-N779 PolarHBondContact O-N 2.97Å
776	Q	59.8	Low	56.3	Low	119 Å²	119	81.1 Å²	81.1	56%	0.556	40%	0.397	S	S	*	.	H	α-helix	trans	-61.9	-47.5	174.3	-73.8	173.2	-15.1	0	0	111.3	K772 T773 R778 N779 H780	K772-Q776 WeakPolarHBondContact O-CG 3.5Å; K772-Q776 PolarHBondContact O-N 2.98Å; T773-Q776 PolarHBondContact O-N 3.41Å; Q776-R778 PolarHBondContact O-N 3.49Å; Q776-N779 PolarHBondContact O-N 3.3Å; Q776-H780 PolarHBondContact O-CD2 2.91Å; Q776-H780 PolarHBondContact O-N 3.45Å
777	L	56.4	Low	55.6	Low	26 Å²	26	81.5 Å²	81.5	14%	0.136	40%	0.402	C	S	.	.	H	α-helix	trans	-62.5	-40.2	177.6	-70.2	163.4	0	0	0	112.4	N717 L721 T773 I774 H780 S781	N717-L777 HydrophobicContact CB-CD2 4.49Å; L721-L777 HydrophobicContact CD1-CD1 4.06Å; L721-L777 HydrophobicContact CD2-CD1 3.69Å; L721-L777 HydrophobicContact CG-CD1 4.32Å; T773-L777 HydrophobicContact CG2-CD1 4.28Å; T773-L777 WeakPolarHBondContact O-CG 3.43Å; T773-L777 PolarHBondContact O-N 3.4Å; I774-L777 PolarHBondContact O-N 3.2Å; L777-H780 PolarHBondContact O-N 2.69Å; L777-S781 PolarHBondContact O-N 2.89Å
778	R	55.6	Low	55.1	Low	163 Å²	163	83.3 Å²	83.3	62%	0.615	41%	0.411	S	S	*	.	H	α-helix	trans	-62.4	-41.7	174.6	-170.2	176.2	-173.6	168.2	4.5	112	I774 Y775 Q776 S781 S782	I774-R778 WeakPolarHBondContact O-CB 3.47Å; I774-R778 PolarHBondContact O-N 2.91Å; Y775-R778 PolarHBondContact O-N 3.22Å; Q776-R778 PolarHBondContact O-N 3.49Å; R778-S781 PolarHBondContact O-N 3.38Å; R778-S782 WeakPolarHBondContact O-CB 3.43Å; R778-S782 PolarHBondContact O-N 3.45Å
779	N	57.9	Low	54.1	Low	98 Å²	98	83.5 Å²	83.5	52%	0.524	41%	0.413	S	S	.	.	H	α-helix	trans	-66.6	-36.3	176.2	-74.2	-14.6	0	0	0	112.3	Y775 Q776 S782 M783	Y775-N779 WeakPolarHBondContact O-CB 3.45Å; Y775-N779 PolarHBondContact O-N 2.97Å; Q776-N779 PolarHBondContact O-N 3.3Å; N779-S782 PolarHBondContact O-N 2.86Å; N779-M783 WeakPolarHBondContact O-CB 3.45Å; N779-M783 WeakPolarHBondContact O-CG 3.43Å; N779-M783 PolarHBondContact O-N 3.44Å
780	H	53.9	Low	53.2	Low	97 Å²	97	83.8 Å²	83.8	45%	0.449	41%	0.414	S	S	.	.	H	α-helix	trans	-65	-44.6	171.8	-80	-68.8	0	0	0	112.4	Q776 L777 S782 M783 I784	Q776-H780 PolarHBondContact O-CD2 2.91Å; Q776-H780 PolarHBondContact O-N 3.45Å; L777-H780 PolarHBondContact O-N 2.69Å; H780-S782 VanDerWaalsContact C-N 3.32Å; H780-S782 PolarHBondContact O-N 2.94Å; H780-M783 PolarHBondContact O-N 3.35Å; H780-I784 WeakPolarHBondContact O-CD1 3.43Å; H780-I784 VanDerWaalsContact O-CG1 3.25Å; H780-I784 WeakPolarHBondContact O-CG1 3.34Å; H780-I784 PolarHBondContact O-N 2.92Å
781	S	46.9	Very low	52.6	Low	42 Å²	42	88 Å²	88	29%	0.294	43%	0.43	S	S	.	.	H	α-helix	trans	-59.4	-42.4	175.1	-170.6	0	0	0	0	112.2	L777 R778 I784 T785	L777-S781 PolarHBondContact O-N 2.89Å; R778-S781 PolarHBondContact O-N 3.38Å; S781-I784 PolarHBondContact O-N 2.96Å; S781-T785 PolarHBondContact O-N 3.33Å; S781-T785 PolarHBondContact O-OG1 2.85Å
782	S	51.5	Low	51.6	Low	74 Å²	74	86.6 Å²	86.6	52%	0.517	43%	0.428	S	S	.	.	H	α-helix	trans	-60.6	-47.8	173.3	-179.2	0	0	0	0	112.3	R778 N779 H780 I784 T785 H786	R778-S782 WeakPolarHBondContact O-CB 3.43Å; R778-S782 PolarHBondContact O-N 3.45Å; N779-S782 PolarHBondContact O-N 2.86Å; H780-S782 VanDerWaalsContact C-N 3.32Å; H780-S782 PolarHBondContact O-N 2.94Å; S782-I784 PolarHBondContact O-N 2.83Å; S782-T785 PolarHBondContact O-N 3.45Å; S782-H786 WeakPolarHBondContact O-CB 3.3Å; S782-H786 PolarHBondContact O-N 3.31Å
783	M	49.3	Very low	50.4	Low	114 Å²	114	85.5 Å²	85.5	56%	0.562	43%	0.425	S	S	*	.	H	α-helix	trans	-59.8	-41.7	176.5	-79	-113.6	69.1	0	0	112.8	N779 H780 T787	N779-M783 WeakPolarHBondContact O-CB 3.45Å; N779-M783 WeakPolarHBondContact O-CG 3.43Å; N779-M783 PolarHBondContact O-N 3.44Å; H780-M783 PolarHBondContact O-N 3.35Å; M783-T787 VanDerWaalsContact O-CB 3.25Å; M783-T787 WeakPolarHBondContact O-CB 3.34Å; M783-T787 PolarHBondContact O-N 2.95Å; M783-T787 PolarHBondContact O-OG1 2.86Å
784	I	47.9	Very low	49.4	Very low	50 Å²	50	89 Å²	89	26%	0.256	44%	0.442	S	S	.	.	H	α-helix	trans	-62.8	-51	177.6	-67.5	158.6	0	0	0	109.8	I714 H780 S781 S782 H786 T787 I788	I714-I784 HydrophobicContact CD1-CD1 3.48Å; I714-I784 VanDerWaalsContact CD1-CD1 3.48Å; I714-I784 HydrophobicContact CG1-CD1 4.32Å; H780-I784 WeakPolarHBondContact O-CD1 3.43Å; H780-I784 VanDerWaalsContact O-CG1 3.25Å; H780-I784 WeakPolarHBondContact O-CG1 3.34Å; H780-I784 PolarHBondContact O-N 2.92Å; S781-I784 PolarHBondContact O-N 2.96Å; S782-I784 PolarHBondContact O-N 2.83Å; I784-H786 VanDerWaalsContact C-N 3.35Å; I784-H786 PolarHBondContact O-N 2.97Å; I784-T787 PolarHBondContact O-N 3.25Å; I784-I788 HydrophobicContact CG2-CD1 3.77Å; I784-I788 WeakPolarHBondContact O-CG1 3.33Å; I784-I788 PolarHBondContact O-N 3.01Å
785	T	48.7	Very low	48.3	Very low	61 Å²	61	90.7 Å²	90.7	37%	0.374	46%	0.458	S	S	.	.	H	α-helix	trans	-60.7	-42.7	179.4	-50	0	0	0	0	111.8	S781 S782 I788 N789	S781-T785 PolarHBondContact O-N 3.33Å; S781-T785 PolarHBondContact O-OG1 2.85Å; S782-T785 PolarHBondContact O-N 3.45Å; T785-I788 PolarHBondContact O-N 3.5Å; T785-N789 PolarHBondContact O-N 2.94Å
786	H	47.8	Very low	47.3	Very low	101 Å²	101	86.9 Å²	86.9	47%	0.468	45%	0.452	S	S	.	.	H	α-helix	trans	-70.7	-31.2	179	-157.5	58.9	0	0	0	112.7	S782 I784 K790	S782-H786 WeakPolarHBondContact O-CB 3.3Å; S782-H786 PolarHBondContact O-N 3.31Å; I784-H786 VanDerWaalsContact C-N 3.35Å; I784-H786 PolarHBondContact O-N 2.97Å; H786-K790 PolarHBondContact NE2-NZ 3.47Å; H786-K790 WeakPolarHBondContact O-CB 3.34Å; H786-K790 PolarHBondContact O-N 2.87Å; H786-K790 VanDerWaalsContact O-N 3.11Å
787	T	44.7	Very low	46	Very low	49 Å²	49	86.1 Å²	86.1	30%	0.301	45%	0.452	S	S	.	.	H	α-helix	trans	-74.4	-36.3	175.5	-57.2	0	0	0	0	112	M783 I784 K791	M783-T787 VanDerWaalsContact O-CB 3.25Å; M783-T787 WeakPolarHBondContact O-CB 3.34Å; M783-T787 PolarHBondContact O-N 2.95Å; M783-T787 PolarHBondContact O-OG1 2.86Å; I784-T787 PolarHBondContact O-N 3.25Å; T787-K791 HydrophobicContact CG2-CD 4.12Å; T787-K791 WeakPolarHBondContact O-CB 3.48Å; T787-K791 WeakPolarHBondContact O-CG 3.45Å; T787-K791 PolarHBondContact O-N 3.42Å; T787-K791 VanDerWaalsContact O-N 3.17Å
788	I	49.8	Very low	44.9	Very low	88 Å²	88	95.5 Å²	95.5	45%	0.451	49%	0.487	S	S	.	.	H	α-helix	trans	-63.2	-50.9	172.4	-69.8	166.7	0	0	0	109.6	I784 T785 K790 K791 S792	I784-I788 HydrophobicContact CG2-CD1 3.77Å; I784-I788 WeakPolarHBondContact O-CG1 3.33Å; I784-I788 PolarHBondContact O-N 3.01Å; T785-I788 PolarHBondContact O-N 3.5Å; I788-K790 PolarHBondContact O-N 2.97Å; I788-K791 PolarHBondContact O-N 3.03Å; I788-K791 VanDerWaalsContact O-N 3.1Å; I788-S792 PolarHBondContact O-N 2.97Å; I788-S792 PolarHBondContact O-OG 2.91Å
789	N	45.7	Very low	43.7	Very low	86 Å²	86	90.8 Å²	90.8	46%	0.46	48%	0.483	S	S	.	.	H	α-helix	trans	-63.4	-44.4	-177.2	-70.5	1.1	0	0	0	113	T785 K791 S792 E793	T785-N789 PolarHBondContact O-N 2.94Å; N789-K791 VanDerWaalsContact C-N 3.26Å; N789-K791 PolarHBondContact O-N 3.4Å; N789-S792 WeakPolarHBondContact CA-OG 3.49Å; N789-S792 PolarHBondContact O-N 2.88Å; N789-S792 PolarHBondContact O-OG 2.92Å; N789-E793 WeakPolarHBondContact O-CG 3.45Å; N789-E793 PolarHBondContact O-N 3.44Å; N789-E793 VanDerWaalsContact O-N 3.14Å
790	K	45.9	Very low	42.4	Very low	116 Å²	116	93.4 Å²	93.4	50%	0.504	50%	0.495	S	S	.	.	H	α-helix	trans	-63.8	-28.2	174.2	-88.4	177.2	169.3	157.8	0	113.6	H786 I788 L794	H786-K790 PolarHBondContact NE2-NZ 3.47Å; H786-K790 WeakPolarHBondContact O-CB 3.34Å; H786-K790 PolarHBondContact O-N 2.87Å; H786-K790 VanDerWaalsContact O-N 3.11Å; I788-K790 PolarHBondContact O-N 2.97Å; K790-L794 WeakPolarHBondContact O-CD1 3.37Å; K790-L794 WeakPolarHBondContact O-CG 3.22Å; K790-L794 PolarHBondContact O-N 2.98Å
791	K	44.6	Very low	41.2	Very low	116 Å²	116	93.4 Å²	93.4	50%	0.504	51%	0.506	S	S	.	.	H	α-helix	trans	-84.3	-30.4	177.1	-75.1	178.4	-179.5	172.6	0	112.8	T787 I788 N789 E793 L794 S795	T787-K791 HydrophobicContact CG2-CD 4.12Å; T787-K791 WeakPolarHBondContact O-CB 3.48Å; T787-K791 WeakPolarHBondContact O-CG 3.45Å; T787-K791 PolarHBondContact O-N 3.42Å; T787-K791 VanDerWaalsContact O-N 3.17Å; I788-K791 PolarHBondContact O-N 3.03Å; I788-K791 VanDerWaalsContact O-N 3.1Å; N789-K791 VanDerWaalsContact C-N 3.26Å; N789-K791 PolarHBondContact O-N 3.4Å; K791-E793 VanDerWaalsContact C-N 3.34Å; K791-L794 PolarHBondContact O-N 3.36Å; K791-S795 WeakPolarHBondContact O-CB 3.49Å; K791-S795 PolarHBondContact O-N 3.46Å; K791-S795 PolarHBondContact O-OG 3.48Å
792	S	41.1	Very low	40.3	Very low	57 Å²	57	98 Å²	98	40%	0.399	53%	0.527	S	S	.	.	H	α-helix	trans	-61.5	-43.4	167.9	44.3	0	0	0	0	111.1	I788 N789 L794 S795 S796	I788-S792 PolarHBondContact O-N 2.97Å; I788-S792 PolarHBondContact O-OG 2.91Å; N789-S792 WeakPolarHBondContact CA-OG 3.49Å; N789-S792 PolarHBondContact O-N 2.88Å; N789-S792 PolarHBondContact O-OG 2.92Å; S792-L794 PolarHBondContact O-N 3.34Å; S792-S795 WeakPolarHBondContact CA-OG 3.45Å; S792-S795 PolarHBondContact O-N 3.42Å; S792-S795 VanDerWaalsContact O-N 3.13Å; S792-S795 PolarHBondContact O-OG 2.94Å; S792-S796 PolarHBondContact O-N 2.95Å; S792-S796 PolarHBondContact O-OG 3.25Å
793	E	37.3	Very low	39.6	Very low	111 Å²	111	102.5 Å²	102.5	52%	0.519	55%	0.545	S	S	.	.	H	α-helix	trans	-59.8	-44.9	173.7	-70	170.5	167.8	0	0	112.2	N789 K791 S795 S796 N797	N789-E793 WeakPolarHBondContact O-CG 3.45Å; N789-E793 PolarHBondContact O-N 3.44Å; N789-E793 VanDerWaalsContact O-N 3.14Å; K791-E793 VanDerWaalsContact C-N 3.34Å; E793-S795 VanDerWaalsContact C-N 3.28Å; E793-S795 PolarHBondContact O-N 3.23Å; E793-S796 PolarHBondContact O-N 3.4Å; E793-S796 PolarHBondContact O-OG 2.86Å; E793-N797 WeakPolarHBondContact O-CB 3.35Å; E793-N797 PolarHBondContact O-N 3.2Å; E793-N797 PolarHBondContact O-ND2 3.29Å; E793-N797 VanDerWaalsContact O-ND2 3.17Å
794	L	38.2	Very low	38.9	Very low	112 Å²	112	100.2 Å²	100.2	59%	0.586	55%	0.552	S	S	*	*	H	α-helix	trans	-65.1	-29.1	175.3	-76.5	163.8	0	0	0	113.3	K790 K791 S792	K790-L794 WeakPolarHBondContact O-CD1 3.37Å; K790-L794 WeakPolarHBondContact O-CG 3.22Å; K790-L794 PolarHBondContact O-N 2.98Å; K791-L794 PolarHBondContact O-N 3.36Å; S792-L794 PolarHBondContact O-N 3.34Å
795	S	34.9	Very low	38.2	Very low	84 Å²	84	106.1 Å²	106.1	59%	0.587	58%	0.583	S	S	*	*	H	α-helix	trans	-79.3	-30.4	175.9	73.6	0	0	0	0	113.4	K791 S792 E793	K791-S795 WeakPolarHBondContact O-CB 3.49Å; K791-S795 PolarHBondContact O-N 3.46Å; K791-S795 PolarHBondContact O-OG 3.48Å; S792-S795 WeakPolarHBondContact CA-OG 3.45Å; S792-S795 PolarHBondContact O-N 3.42Å; S792-S795 VanDerWaalsContact O-N 3.13Å; S792-S795 PolarHBondContact O-OG 2.94Å; E793-S795 VanDerWaalsContact C-N 3.28Å; E793-S795 PolarHBondContact O-N 3.23Å
796	S	34.7	Very low	37.5	Very low	60 Å²	60	108.6 Å²	108.6	42%	0.42	60%	0.603	S	S	.	*	H	α-helix	trans	-76.7	-32	173.3	61.8	0	0	0	0	112.2	S792 E793 Y798 A799	S792-S796 PolarHBondContact O-N 2.95Å; S792-S796 PolarHBondContact O-OG 3.25Å; E793-S796 PolarHBondContact O-N 3.4Å; E793-S796 PolarHBondContact O-OG 2.86Å; S796-Y798 PolarHBondContact O-N 3.28Å; S796-Y798 VanDerWaalsContact O-N 3.08Å; S796-A799 CarbonylContact O-C 3.6Å; S796-A799 WeakPolarHBondContact O-CA 3.37Å; S796-A799 PolarHBondContact O-N 3.48Å
797	N	33.6	Very low	36.6	Very low	104 Å²	104	114 Å²	114	56%	0.556	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.4	-4.9	-179.5	-72	-20.8	0	0	0	114.9	E793	E793-N797 WeakPolarHBondContact O-CB 3.35Å; E793-N797 PolarHBondContact O-N 3.2Å; E793-N797 PolarHBondContact O-ND2 3.29Å; E793-N797 VanDerWaalsContact O-ND2 3.17Å
798	Y	33.8	Very low	36	Very low	222 Å²	222	116.7 Å²	116.7	87%	0.871	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.9	5.6	167.2	-82.8	-86.2	0	0	0	113.6	S796	S796-Y798 PolarHBondContact O-N 3.28Å; S796-Y798 VanDerWaalsContact O-N 3.08Å
799	A	30.4	Very low	35.1	Very low	65 Å²	65	118.2 Å²	118.2	54%	0.537	66%	0.662	S	S	.	*	S	Bend	trans	-132	81.7	178.9	0	0	0	0	0	111.3	S796	S796-A799 CarbonylContact O-C 3.6Å; S796-A799 WeakPolarHBondContact O-CA 3.37Å; S796-A799 PolarHBondContact O-N 3.48Å
800	I	29.3	Very low	34.7	Very low	153 Å²	153	120.1 Å²	120.1	79%	0.785	67%	0.671	S	S	*	*			trans	53.9	73	161.6	-43.8	176.8	0	0	0	114	N802	I800-N802 VanDerWaalsContact C-N 3.3Å; I800-N802 PolarHBondContact O-N 2.95Å
801	S	29.1	Very low	34.6	Very low	96 Å²	96	117 Å²	117	67%	0.671	66%	0.664	S	S	*	*			trans	-76	78.7	169.5	61.6	0	0	0	0	111.7
802	N	28.7	Very low	35	Very low	138 Å²	138	119.2 Å²	119.2	74%	0.738	68%	0.676	S	S	*	*			trans	-80.2	103	152.4	-83.8	-20.7	0	0	0	107.7	I800	I800-N802 VanDerWaalsContact C-N 3.3Å; I800-N802 PolarHBondContact O-N 2.95Å
803	D	37	Very low	35.6	Very low	169 Å²	169	122.4 Å²	122.4	90%	0.904	69%	0.689	S	S	*	*			trans	-176.9	143.3	139.9	-99.1	-23.1	0	0	0	113.2
804	G	33.3	Very low	36.6	Very low	67 Å²	67	120.1 Å²	120.1	69%	0.691	69%	0.685	S	S	*	*	S	Bend	trans	75.5	89.9	149.8	0	0	0	0	0	120.1
805	N	32.9	Very low	37.7	Very low	173 Å²	173	119.4 Å²	119.4	93%	0.925	68%	0.681	S	S	*	*	S	Bend	trans	63.9	59.3	146.3	-66.2	-18.3	0	0	0	120.2
806	S	35.7	Very low	39.4	Very low	113 Å²	113	121 Å²	121	79%	0.79	68%	0.68	S	S	*	*			trans	-160.6	133.9	132.9	44.1	0	0	0	0	109.6	P808	S806-P808 WeakPolarHBondContact O-CD 3.43Å
807	K	28.8	Very low	41.1	Very low	214 Å²	214	122.8 Å²	122.8	93%	0.93	68%	0.684	S	S	*	*			trans	-78.6	115	-179.2	-77.6	177.3	174.2	174.3	0	111
808	P	30.8	Very low	42.7	Very low	107 Å²	107	120.5 Å²	120.5	70%	0.695	68%	0.679	S	S	*	*			trans	-89.7	114.3	150.4	32.3	-20.6	0	0	0	107.6	S806 I810	S806-P808 WeakPolarHBondContact O-CD 3.43Å; P808-I810 PolarHBondContact O-N 3.47Å
809	S	31.9	Very low	44.4	Very low	119 Å²	119	113 Å²	113	83%	0.832	65%	0.651	S	S	*	*			trans	-72	80.5	174.7	57.1	0	0	0	0	110.6	S811	S809-S811 PolarHBondContact O-N 3.45Å
810	I	36.8	Very low	46.3	Very low	126 Å²	126	115.2 Å²	115.2	65%	0.646	65%	0.652	S	S	*	*			trans	-57.2	119.3	159.4	-64.4	176	0	0	0	105.8	P808 Q812	P808-I810 PolarHBondContact O-N 3.47Å; I810-Q812 PolarHBondContact O-N 3.36Å
811	S	43.3	Very low	48.1	Very low	52 Å²	52	113.6 Å²	113.6	36%	0.364	64%	0.639	S	S	.	*			trans	-60.1	143.5	-179	68.5	0	0	0	0	109.7	S809 D813 S814 L815	S809-S811 PolarHBondContact O-N 3.45Å; S811-D813 PolarHBondContact O-N 2.92Å; S811-D813 VanDerWaalsContact O-N 3.11Å; S811-S814 WeakPolarHBondContact O-CA 3.47Å; S811-S814 WeakPolarHBondContact O-CB 3.43Å; S811-S814 PolarHBondContact O-N 2.99Å; S811-S814 PolarHBondContact OG-N 3.19Å; S811-S814 PolarHBondContact OG-OG 3.46Å; S811-L815 PolarHBondContact O-N 3.23Å
812	Q	53.5	Low	49.9	Very low	162 Å²	162	110.7 Å²	110.7	76%	0.757	62%	0.621	S	S	*	*	H	α-helix	trans	-55.5	-32.1	178.1	-159.6	169.4	-2.2	0	0	110.9	I810 Q816	I810-Q812 PolarHBondContact O-N 3.36Å; Q812-Q816 WeakPolarHBondContact O-CB 3.48Å; Q812-Q816 PolarHBondContact O-N 2.93Å
813	D	53	Low	51.9	Low	123 Å²	123	104.5 Å²	104.5	66%	0.658	59%	0.589	S	S	*	*	H	α-helix	trans	-62.4	-40	171.2	-53.3	-36.3	0	0	0	113.7	S811 Q816 L817	S811-D813 PolarHBondContact O-N 2.92Å; S811-D813 VanDerWaalsContact O-N 3.11Å; D813-Q816 PolarHBondContact O-N 3.37Å; D813-L817 WeakPolarHBondContact O-CB 3.3Å; D813-L817 PolarHBondContact O-N 2.97Å
814	S	58.7	Low	53.4	Low	63 Å²	63	103.5 Å²	103.5	44%	0.441	58%	0.579	S	S	.	*	H	α-helix	trans	-68.5	-40.4	179.8	-60.8	0	0	0	0	111.2	S811 L817 A818	S811-S814 WeakPolarHBondContact O-CA 3.47Å; S811-S814 WeakPolarHBondContact O-CB 3.43Å; S811-S814 PolarHBondContact O-N 2.99Å; S811-S814 PolarHBondContact OG-N 3.19Å; S811-S814 PolarHBondContact OG-OG 3.46Å; S814-L817 PolarHBondContact O-N 3.36Å; S814-A818 WeakPolarHBondContact O-CB 3.45Å; S814-A818 PolarHBondContact O-N 2.66Å
815	L	62.3	Low	54.9	Low	97 Å²	97	106.9 Å²	106.9	51%	0.508	58%	0.579	S	S	.	*	H	α-helix	trans	-69.3	-42.1	174.8	-176	62.7	0	0	0	111.5	S811 A818 K819	S811-L815 PolarHBondContact O-N 3.23Å; L815-A818 PolarHBondContact O-N 2.6Å; L815-K819 PolarHBondContact O-N 2.97Å
816	Q	70.9	Confident	56.3	Low	119 Å²	119	103.4 Å²	103.4	56%	0.556	56%	0.56	S	S	*	*	H	α-helix	trans	-62.4	-41	173	-82	-153.2	-7.7	0	0	112.3	Q812 D813 A818 K819 M820	Q812-Q816 WeakPolarHBondContact O-CB 3.48Å; Q812-Q816 PolarHBondContact O-N 2.93Å; D813-Q816 PolarHBondContact O-N 3.37Å; Q816-A818 VanDerWaalsContact C-N 3.33Å; Q816-A818 PolarHBondContact O-N 2.85Å; Q816-K819 PolarHBondContact O-N 3.48Å; Q816-M820 WeakPolarHBondContact O-CB 3.35Å; Q816-M820 PolarHBondContact O-N 2.95Å
817	L	69.5	Low	57.6	Low	97 Å²	97	103.8 Å²	103.8	51%	0.508	56%	0.562	S	S	.	*	H	α-helix	trans	-65.4	-37.2	177.6	-174.5	64.6	0	0	0	111.9	D813 S814 K821	D813-L817 WeakPolarHBondContact O-CB 3.3Å; D813-L817 PolarHBondContact O-N 2.97Å; S814-L817 PolarHBondContact O-N 3.36Å; L817-K821 WeakPolarHBondContact O-CB 3.29Å; L817-K821 WeakPolarHBondContact O-CG 3.39Å; L817-K821 PolarHBondContact O-N 2.92Å
818	A	66.9	Low	59.6	Low	55 Å²	55	96.4 Å²	96.4	46%	0.455	53%	0.532	S	S	.	.	H	α-helix	trans	-66.2	-46.9	172.8	0	0	0	0	0	111.8	S814 L815 Q816 M820 K821 A822	S814-A818 WeakPolarHBondContact O-CB 3.45Å; S814-A818 PolarHBondContact O-N 2.66Å; L815-A818 PolarHBondContact O-N 2.6Å; Q816-A818 VanDerWaalsContact C-N 3.33Å; Q816-A818 PolarHBondContact O-N 2.85Å; A818-M820 PolarHBondContact O-N 3.44Å; A818-K821 PolarHBondContact O-N 3.45Å; A818-A822 WeakPolarHBondContact O-CB 3.47Å; A818-A822 PolarHBondContact O-N 3.07Å
819	K	70.6	Confident	62	Low	65 Å²	65	93.9 Å²	93.9	28%	0.283	52%	0.517	S	S	.	.	H	α-helix	trans	-58.9	-44.1	173.8	-76.6	-174.5	167.7	-173	0	112.1	L815 Q816 A822 A823 L830 L833 E834	L815-K819 PolarHBondContact O-N 2.97Å; Q816-K819 PolarHBondContact O-N 3.48Å; K819-A822 PolarHBondContact O-N 2.6Å; K819-A823 WeakPolarHBondContact O-CB 3.47Å; K819-A823 PolarHBondContact O-N 3.36Å; K819-L830 HydrophobicContact CB-CD1 4Å; K819-L833 HydrophobicContact CB-CD2 4.48Å; K819-L833 WeakPolarHBondContact O-CD2 3.36Å; K819-E834 IonicContact NZ-OE1 3.65Å; K819-E834 PolarHBondContact NZ-OE1 3.49Å
820	M	69.8	Low	63.9	Low	112 Å²	112	91.3 Å²	91.3	55%	0.552	49%	0.494	S	S	*	.	H	α-helix	trans	-59.1	-47.8	175.3	-105.6	-177.1	59.3	0	0	111.8	Q816 A818 A823 E824 L830	Q816-M820 WeakPolarHBondContact O-CB 3.35Å; Q816-M820 PolarHBondContact O-N 2.95Å; A818-M820 PolarHBondContact O-N 3.44Å; M820-A823 PolarHBondContact O-N 2.99Å; M820-E824 WeakPolarHBondContact O-CB 3.41Å; M820-E824 PolarHBondContact O-N 2.96Å; M820-L830 HydrophobicContact CG-CD1 4.37Å
821	K	67.1	Low	65.9	Low	119 Å²	119	90.4 Å²	90.4	52%	0.517	49%	0.49	S	S	.	.	H	α-helix	trans	-64.3	-39.5	177.5	-78.3	-176.8	174.8	-174.3	0	112.5	L817 A818 E824 I825	L817-K821 WeakPolarHBondContact O-CB 3.29Å; L817-K821 WeakPolarHBondContact O-CG 3.39Å; L817-K821 PolarHBondContact O-N 2.92Å; A818-K821 PolarHBondContact O-N 3.45Å; K821-E824 PolarHBondContact O-N 3.29Å; K821-I825 WeakPolarHBondContact O-CB 3.45Å; K821-I825 WeakPolarHBondContact O-CD1 3.22Å; K821-I825 WeakPolarHBondContact O-CG1 3.29Å; K821-I825 PolarHBondContact O-N 3.22Å
822	A	65.6	Low	67.3	Low	35 Å²	35	90.8 Å²	90.8	29%	0.289	49%	0.488	S	S	.	.	H	α-helix	trans	-64.6	-42.9	176.1	0	0	0	0	0	111.5	A818 K819 I825 L826 L833	A818-A822 WeakPolarHBondContact O-CB 3.47Å; A818-A822 PolarHBondContact O-N 3.07Å; K819-A822 PolarHBondContact O-N 2.6Å; A822-I825 PolarHBondContact O-N 3.45Å; A822-L826 VanDerWaalsContact O-CB 3.32Å; A822-L826 WeakPolarHBondContact O-CB 3.35Å; A822-L826 VanDerWaalsContact O-CG 3.31Å; A822-L826 WeakPolarHBondContact O-CG 3.5Å; A822-L826 PolarHBondContact O-N 3.01Å; A822-L833 HydrophobicContact CB-CD2 3.8Å
823	A	71	Confident	68.1	Low	8 Å²	8	84 Å²	84	7%	0.066	46%	0.456	C	S	.	.	H	α-helix	trans	-63.3	-41.7	174.7	0	0	0	0	0	112	K819 M820 L826 C827 L828 L830 L833	K819-A823 WeakPolarHBondContact O-CB 3.47Å; K819-A823 PolarHBondContact O-N 3.36Å; M820-A823 PolarHBondContact O-N 2.99Å; A823-L826 PolarHBondContact O-N 3.21Å; A823-C827 PolarHBondContact O-N 3.12Å; A823-L828 PolarHBondContact O-N 2.93Å; A823-L830 HydrophobicContact CB-CD1 4.22Å; A823-L833 HydrophobicContact CB-CB 4.45Å; A823-L833 HydrophobicContact CB-CD2 4.07Å
824	E	68.1	Low	69	Low	148 Å²	148	81.1 Å²	81.1	69%	0.692	44%	0.439	S	S	*	.	H	α-helix	trans	-63.4	-42.6	175	-173.6	178.9	-167	0	0	112.2	M820 K821	M820-E824 WeakPolarHBondContact O-CB 3.41Å; M820-E824 PolarHBondContact O-N 2.96Å; K821-E824 PolarHBondContact O-N 3.29Å
825	I	66.2	Low	69.5	Low	137 Å²	137	84.2 Å²	84.2	70%	0.703	45%	0.445	S	S	*	.	H	α-helix	trans	-67.2	-39	177.1	-72.2	163.6	0	0	0	111.6	K821 A822	K821-I825 WeakPolarHBondContact O-CB 3.45Å; K821-I825 WeakPolarHBondContact O-CD1 3.22Å; K821-I825 WeakPolarHBondContact O-CG1 3.29Å; K821-I825 PolarHBondContact O-N 3.22Å; A822-I825 PolarHBondContact O-N 3.45Å
826	L	62.6	Low	69.1	Low	101 Å²	101	84 Å²	84	53%	0.529	44%	0.444	S	S	.	.	H	α-helix	trans	-89.4	-1.8	-176.9	-65.6	170	0	0	0	113.8	A822 A823 L828 L833	A822-L826 VanDerWaalsContact O-CB 3.32Å; A822-L826 WeakPolarHBondContact O-CB 3.35Å; A822-L826 VanDerWaalsContact O-CG 3.31Å; A822-L826 WeakPolarHBondContact O-CG 3.5Å; A822-L826 PolarHBondContact O-N 3.01Å; A823-L826 PolarHBondContact O-N 3.21Å; L826-L828 HydrophobicContact CB-CD1 3.87Å; L826-L828 HydrophobicContact CB-CG 4.07Å; L826-L828 HydrophobicContact CD1-CD1 4.32Å; L826-L828 PolarHBondContact O-N 3.32Å; L826-L833 HydrophobicContact CD1-CD1 3.73Å
827	C	62.3	Low	68.2	Low	121 Å²	121	82.1 Å²	82.1	82%	0.818	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.3	31.9	-174.9	-63.1	0	0	0	0	114.2	A823	A823-C827 PolarHBondContact O-N 3.12Å
828	L	71.4	Confident	66.9	Low	59 Å²	59	83.6 Å²	83.6	31%	0.309	44%	0.443	S	S	.	.			trans	-102.4	156	178.8	-67.9	170.2	0	0	0	110.9	A823 L826 D832 L833 L836	A823-L828 PolarHBondContact O-N 2.93Å; L826-L828 HydrophobicContact CB-CD1 3.87Å; L826-L828 HydrophobicContact CB-CG 4.07Å; L826-L828 HydrophobicContact CD1-CD1 4.32Å; L826-L828 PolarHBondContact O-N 3.32Å; L828-D832 HydrophobicContact CB-CB 4.47Å; L828-D832 HydrophobicContact CD2-CB 4.32Å; L828-L833 HydrophobicContact CD1-CD1 4.29Å; L828-L836 HydrophobicContact CD1-CD1 3.44Å; L828-L836 VanDerWaalsContact CD1-CD1 3.44Å
829	S	79.8	Confident	65.5	Low	54 Å²	54	87.1 Å²	87.1	38%	0.378	45%	0.454	S	S	.	.			trans	-70	155.7	163.2	87.1	0	0	0	0	109.9	N831 D832 L833	S829-N831 PolarHBondContact O-N 3.47Å; S829-N831 PolarHBondContact OG-N 3.08Å; S829-D832 VanDerWaalsContact CB-OD2 3.29Å; S829-D832 WeakPolarHBondContact CB-OD2 3.35Å; S829-D832 PolarHBondContact O-N 2.94Å; S829-D832 PolarHBondContact OG-N 3.29Å; S829-D832 VanDerWaalsContact OG-N 3.16Å; S829-D832 PolarHBondContact OG-OD2 3.49Å; S829-L833 PolarHBondContact O-N 2.87Å
830	L	73	Confident	63.9	Low	65 Å²	65	91.3 Å²	91.3	34%	0.34	48%	0.479	S	S	.	.	H	α-helix	trans	-57.6	-34.9	176.8	-157.3	81	0	0	0	111.5	K819 M820 A823 E834	K819-L830 HydrophobicContact CB-CD1 4Å; M820-L830 HydrophobicContact CG-CD1 4.37Å; A823-L830 HydrophobicContact CB-CD1 4.22Å; L830-E834 WeakPolarHBondContact O-CG 3.29Å; L830-E834 PolarHBondContact O-N 3.14Å
831	N	77.9	Confident	62.4	Low	107 Å²	107	93.1 Å²	93.1	57%	0.572	49%	0.486	S	S	*	.	H	α-helix	trans	-67.6	-36.9	176.1	-69.7	2.5	0	0	0	112.2	S829 E834 K835	S829-N831 PolarHBondContact O-N 3.47Å; S829-N831 PolarHBondContact OG-N 3.08Å; N831-E834 PolarHBondContact O-N 3.36Å; N831-K835 VanDerWaalsContact O-CG 3.31Å; N831-K835 WeakPolarHBondContact O-CG 3.42Å; N831-K835 PolarHBondContact O-N 3.47Å
832	D	73.5	Confident	61	Low	59 Å²	59	94.2 Å²	94.2	32%	0.316	50%	0.498	S	S	.	.	H	α-helix	trans	-77.9	-33.4	-179.6	-55.4	-46.5	0	0	0	111.3	L828 S829 E834 K835 L836	L828-D832 HydrophobicContact CB-CB 4.47Å; L828-D832 HydrophobicContact CD2-CB 4.32Å; S829-D832 VanDerWaalsContact CB-OD2 3.29Å; S829-D832 WeakPolarHBondContact CB-OD2 3.35Å; S829-D832 PolarHBondContact O-N 2.94Å; S829-D832 PolarHBondContact OG-N 3.29Å; S829-D832 VanDerWaalsContact OG-N 3.16Å; S829-D832 PolarHBondContact OG-OD2 3.49Å; D832-E834 VanDerWaalsContact C-N 3.34Å; D832-K835 PolarHBondContact O-N 2.95Å; D832-K835 IonicContact OD1-NZ 3.84Å; D832-K835 PolarHBondContact OD1-NZ 3.27Å; D832-L836 WeakPolarHBondContact O-CG 3.45Å; D832-L836 PolarHBondContact O-N 3.41Å
833	L	69.8	Low	59.4	Low	19 Å²	19	97.8 Å²	97.8	10%	0.099	52%	0.52	C	S	.	.	H	α-helix	trans	-60.7	-44	166.8	-173.6	72.2	0	0	0	111.2	K819 A822 A823 L826 L828 S829 L836 T837	K819-L833 HydrophobicContact CB-CD2 4.48Å; K819-L833 WeakPolarHBondContact O-CD2 3.36Å; A822-L833 HydrophobicContact CB-CD2 3.8Å; A823-L833 HydrophobicContact CB-CB 4.45Å; A823-L833 HydrophobicContact CB-CD2 4.07Å; L826-L833 HydrophobicContact CD1-CD1 3.73Å; L828-L833 HydrophobicContact CD1-CD1 4.29Å; S829-L833 PolarHBondContact O-N 2.87Å; L833-L836 PolarHBondContact O-N 3.1Å; L833-T837 PolarHBondContact O-N 3.13Å; L833-T837 PolarHBondContact O-OG1 3.44Å
834	E	72.1	Confident	57.4	Low	64 Å²	64	103.1 Å²	103.1	30%	0.299	56%	0.556	S	S	.	*	H	α-helix	trans	-63.4	-44.1	176.9	-75.6	-171.2	156.2	0	0	111.9	K819 L830 N831 D832 L836 T837 F838	K819-E834 IonicContact NZ-OE1 3.65Å; K819-E834 PolarHBondContact NZ-OE1 3.49Å; L830-E834 WeakPolarHBondContact O-CG 3.29Å; L830-E834 PolarHBondContact O-N 3.14Å; N831-E834 PolarHBondContact O-N 3.36Å; D832-E834 VanDerWaalsContact C-N 3.34Å; E834-L836 VanDerWaalsContact C-N 3.32Å; E834-L836 PolarHBondContact O-N 2.91Å; E834-T837 WeakPolarHBondContact CA-OG1 3.37Å; E834-T837 PolarHBondContact O-N 3.03Å; E834-T837 VanDerWaalsContact O-N 3.11Å; E834-T837 PolarHBondContact O-OG1 2.95Å; E834-F838 WeakPolarHBondContact O-CD2 3.42Å; E834-F838 PolarHBondContact O-N 3.4Å
835	K	69.1	Low	55.7	Low	127 Å²	127	105 Å²	105	55%	0.552	56%	0.564	S	S	*	*	H	α-helix	trans	-56.6	-42.3	173.2	-71.5	170.6	-164.1	160.8	0	112.7	N831 D832 F838 L839	N831-K835 VanDerWaalsContact O-CG 3.31Å; N831-K835 WeakPolarHBondContact O-CG 3.42Å; N831-K835 PolarHBondContact O-N 3.47Å; D832-K835 PolarHBondContact O-N 2.95Å; D832-K835 IonicContact OD1-NZ 3.84Å; D832-K835 PolarHBondContact OD1-NZ 3.27Å; K835-F838 PolarHBondContact O-N 3.24Å; K835-L839 PolarHBondContact O-N 3.48Å
836	L	53.1	Low	54.1	Low	94 Å²	94	104.2 Å²	104.2	49%	0.492	57%	0.571	S	S	.	*	H	α-helix	trans	-64.5	-39.8	175.5	-71.7	174.2	0	0	0	112	L828 D832 L833 E834 F838 L839	L828-L836 HydrophobicContact CD1-CD1 3.44Å; L828-L836 VanDerWaalsContact CD1-CD1 3.44Å; D832-L836 WeakPolarHBondContact O-CG 3.45Å; D832-L836 PolarHBondContact O-N 3.41Å; L833-L836 PolarHBondContact O-N 3.1Å; E834-L836 VanDerWaalsContact C-N 3.32Å; E834-L836 PolarHBondContact O-N 2.91Å; L836-F838 PolarHBondContact O-N 3.32Å; L836-L839 HydrophobicContact CD2-CD1 4.34Å; L836-L839 PolarHBondContact O-N 2.9Å
837	T	53.5	Low	52.8	Low	78 Å²	78	106.9 Å²	106.9	48%	0.479	59%	0.586	S	S	.	*	H	α-helix	trans	-69.5	-18.6	176.1	54.3	0	0	0	0	114.4	L833 E834	L833-T837 PolarHBondContact O-N 3.13Å; L833-T837 PolarHBondContact O-OG1 3.44Å; E834-T837 WeakPolarHBondContact CA-OG1 3.37Å; E834-T837 PolarHBondContact O-N 3.03Å; E834-T837 VanDerWaalsContact O-N 3.11Å; E834-T837 PolarHBondContact O-OG1 2.95Å
838	F	41.2	Very low	51.4	Low	129 Å²	129	110.3 Å²	110.3	57%	0.566	59%	0.587	S	S	*	*	H	α-helix	trans	-88.2	-12.1	174.4	-80.9	-66.6	0	0	0	114.2	E834 K835 L836	E834-F838 WeakPolarHBondContact O-CD2 3.42Å; E834-F838 PolarHBondContact O-N 3.4Å; K835-F838 PolarHBondContact O-N 3.24Å; L836-F838 PolarHBondContact O-N 3.32Å
839	L	37.8	Very low	49.6	Very low	129 Å²	129	116.5 Å²	116.5	68%	0.675	61%	0.614	S	S	*	*	H	α-helix	trans	-76.7	-24.9	-178.6	-84.1	160	0	0	0	113.7	K835 L836	K835-L839 PolarHBondContact O-N 3.48Å; L836-L839 HydrophobicContact CD2-CD1 4.34Å; L836-L839 PolarHBondContact O-N 2.9Å
840	D	37.5	Very low	47.2	Very low	152 Å²	152	121.4 Å²	121.4	81%	0.813	64%	0.636	S	S	*	*	S	Bend	trans	-86.9	-9.8	-179	-106.3	-12.6	0	0	0	114.6
841	Q	38.6	Very low	45.3	Very low	150 Å²	150	125.3 Å²	125.3	70%	0.701	66%	0.662	S	S	*	*	S	Bend	trans	-96.9	-4.9	-176	-68.6	-168.3	-19.6	0	0	114.7
842	N	36.7	Very low	43.1	Very low	143 Å²	143	127.1 Å²	127.1	77%	0.765	67%	0.672	S	S	*	*	S	Bend	trans	-100.3	10.9	-178.6	-68.6	-23.8	0	0	0	114.1
843	S	33.3	Very low	41.1	Very low	109 Å²	109	130.5 Å²	130.5	76%	0.762	69%	0.689	S	S	*	*	S	Bend	trans	-102.5	4.1	-176.3	-171.5	0	0	0	0	115
844	C	28.9	Very low	39.4	Very low	120 Å²	120	136.6 Å²	136.6	81%	0.811	72%	0.722	S	S	*	*	S	Bend	trans	-135.6	47.5	-171.1	-129.3	0	0	0	0	114
845	H	31.1	Very low	37.4	Very low	187 Å²	187	140.3 Å²	140.3	87%	0.866	74%	0.743	S	S	*	*			trans	-137.8	88.5	169.9	-82.2	-12.9	0	0	0	110.9
846	S	32.2	Very low	35.9	Very low	121 Å²	121	141.9 Å²	141.9	85%	0.846	76%	0.758	S	S	*	*			trans	-150	130.5	151.5	-64.6	0	0	0	0	109.8
847	D	35.8	Very low	35.1	Very low	157 Å²	157	144.2 Å²	144.2	84%	0.84	77%	0.769	S	S	*	*			trans	-58.3	162.7	178.1	-69.1	-78.8	0	0	0	116.1
848	K	32.2	Very low	34.4	Very low	194 Å²	194	148.3 Å²	148.3	84%	0.843	78%	0.783	S	S	*	*			trans	-40	130.7	163.3	-53.1	156.6	-178.3	169.8	0	112.4
849	Q	35	Very low	34.3	Very low	188 Å²	188	149 Å²	149	88%	0.879	79%	0.793	S	S	*	*				-172.4	148.3	112.4	-103.7	169.3	-5.8	0	0	111.2
850	D	28.8	Very low	34.4	Very low	157 Å²	157	149.2 Å²	149.2	84%	0.84	80%	0.795	S	S	*	*			trans	-64.3	142.6	172.7	-49.8	-84.6	0	0	0	110.9
851	V	33.9	Very low	34.4	Very low	147 Å²	147	147.3 Å²	147.3	89%	0.891	78%	0.784	S	S	*	*				-166.9	139.6	125.6	144	0	0	0	0	108.1
852	N	30	Very low	34.4	Very low	145 Å²	145	150.1 Å²	150.1	78%	0.775	79%	0.789	S	S	*	*			trans	-89.8	177.8	-179.4	-168.6	20.2	0	0	0	109.9
853	I	32.4	Very low	34.4	Very low	131 Å²	131	150.5 Å²	150.5	67%	0.672	80%	0.795	S	S	*	*			trans	103.8	120.8	158.1	-57.5	170.8	0	0	0	117.4
854	D	34.7	Very low	34.4	Very low	147 Å²	147	153.3 Å²	153.3	79%	0.786	80%	0.796	S	S	*	*			trans	75.3	133.7	153.6	-61.7	-15.2	0	0	0	124
855	N	29.6	Very low	34.6	Very low	141 Å²	141	156.4 Å²	156.4	75%	0.754	80%	0.799	S	S	*	*			trans	-78.7	149.6	164.9	-38.8	-84	0	0	0	108.2
856	D	37.6	Very low	34.6	Very low	161 Å²	161	153 Å²	153	86%	0.861	79%	0.792	S	S	*	*				-162.7	161.7	122.8	-96.7	-23.5	0	0	0	110.5
857	I	36.5	Very low	34.5	Very low	143 Å²	143	155.1 Å²	155.1	73%	0.733	79%	0.793	S	S	*	*			trans	-99.7	168.5	-147.6	-41.9	173.5	0	0	0	110.4
858	E	38.1	Very low	34.3	Very low	164 Å²	164	153 Å²	153	77%	0.766	79%	0.791	S	S	*	*			trans	102.6	134.7	152.1	-55.4	-166.8	155.8	0	0	119.4
859	D	40.4	Very low	34.2	Very low	143 Å²	143	154.1 Å²	154.1	77%	0.765	80%	0.796	S	S	*	*			trans	64.4	141.5	160.5	-52.3	-17.9	0	0	0	119
860	D	38.2	Very low	34.3	Very low	134 Å²	134	152.2 Å²	152.2	72%	0.717	79%	0.792	S	S	*	*			cis	-158	168.4	9.8	-148.2	-16.6	0	0	0	113.4
861	D	38.5	Very low	34.4	Very low	112 Å²	112	151.5 Å²	151.5	60%	0.599	79%	0.788	S	S	*	*			trans	56.1	98.1	149.1	-94.5	-23.7	0	0	0	123.4
862	R	37.7	Very low	34.2	Very low	209 Å²	209	147.2 Å²	147.2	79%	0.789	77%	0.774	S	S	*	*				46.5	117.5	118.3	-69.6	-178.3	161.8	155.3	-9.5	121.6
863	V	36.9	Very low	34.5	Very low	150 Å²	150	145.4 Å²	145.4	91%	0.909	77%	0.768	S	S	*	*				-139.6	124.3	118.1	-178	0	0	0	0	109.3
864	E	33.9	Very low	34.6	Very low	168 Å²	168	147.5 Å²	147.5	79%	0.785	77%	0.772	S	S	*	*			trans	-85.7	141.6	172.2	-61.6	176.6	129.4	0	0	111
865	E	33.2	Very low	34.5	Very low	185 Å²	185	148 Å²	148	86%	0.864	77%	0.77	S	S	*	*				-163	106.3	129.8	-114	-178.4	172.2	0	0	113.8
866	V	30.1	Very low	34.5	Very low	117 Å²	117	149.9 Å²	149.9	71%	0.709	77%	0.766	S	S	*	*			trans	48.2	100.4	140.2	-171.9	0	0	0	0	119.2
867	N	30.6	Very low	34.5	Very low	164 Å²	164	148.7 Å²	148.7	88%	0.877	76%	0.76	S	S	*	*			trans	-164.6	64.9	137.3	-99.3	-41.2	0	0	0	112.2	F869	N867-F869 PolarHBondContact O-N 3.24Å
868	S	32.9	Very low	34.3	Very low	113 Å²	113	150.3 Å²	150.3	79%	0.79	76%	0.764	S	S	*	*			trans	-87.5	84	179	61.2	0	0	0	0	112.7	N870	S868-N870 PolarHBondContact O-N 2.91Å
869	F	30	Very low	34.2	Very low	218 Å²	218	151.7 Å²	151.7	96%	0.956	77%	0.77	S	S	*	*			trans	-88.1	84.1	162.1	-124.6	-84.1	0	0	0	108.7	N867	N867-F869 PolarHBondContact O-N 3.24Å
870	N	35.9	Very low	34	Very low	147 Å²	147	151.2 Å²	151.2	79%	0.786	76%	0.764	S	S	*	*			trans	-95.2	115.9	-169.5	-144	21.1	0	0	0	113.1	S868	S868-N870 PolarHBondContact O-N 2.91Å
871	D	32	Very low	34	Very low	142 Å²	142	153.8 Å²	153.8	76%	0.759	77%	0.768	S	S	*	*			trans	66.6	151.3	143.2	-145.4	-1.6	0	0	0	120.8
872	G	29.6	Very low	34.2	Very low	58 Å²	58	153.7 Å²	153.7	60%	0.598	77%	0.767	S	S	*	*			trans	117.7	62.5	166.4	0	0	0	0	0	117.6
873	T	35.9	Very low	34.6	Very low	107 Å²	107	145.9 Å²	145.9	66%	0.656	75%	0.745	S	S	*	*				-170.7	95.6	129.6	15	0	0	0	0	112.2
874	K	33.7	Very low	35.1	Very low	174 Å²	174	148 Å²	148	76%	0.757	74%	0.742	S	S	*	*			trans	-69.4	160.6	158.2	-66.5	171.7	179.7	172.2	0	109.3
875	H	33.1	Very low	35.9	Very low	158 Å²	158	144.1 Å²	144.1	73%	0.731	73%	0.733	S	S	*	*			trans	75.7	66.8	178.2	-49.4	-72.3	0	0	0	118.2
876	R	30.9	Very low	36.8	Very low	180 Å²	180	137.8 Å²	137.8	68%	0.679	71%	0.707	S	S	*	*	S	Bend	trans	-159.8	128.7	141.9	-108.3	171.2	179.8	171	2.1	108.2
877	N	36.3	Very low	37.8	Very low	137 Å²	137	135.8 Å²	135.8	73%	0.733	69%	0.692	S	S	*	*			trans	110.1	25	175.9	-55.6	-22.1	0	0	0	119.4	H879	N877-H879 PolarHBondContact O-N 3.48Å
878	E	33.4	Very low	39.1	Very low	176 Å²	176	132.7 Å²	132.7	82%	0.822	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.1	-4.8	174	-70.2	-176.8	167.3	0	0	114.8
879	H	34.4	Very low	40.4	Very low	194 Å²	194	130 Å²	130	90%	0.898	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.4	1.6	-177.1	-98.5	-78.3	0	0	0	116.6	N877	N877-H879 PolarHBondContact O-N 3.48Å
880	E	37.6	Very low	41.5	Very low	133 Å²	133	127 Å²	127	62%	0.621	64%	0.637	S	S	*	*	S	Bend	trans	-136.3	18.2	-171.9	-130.4	-175.9	176.4	0	0	117.7	K697	K697-E880 IonicContact NZ-OE1 2.6Å; K697-E880 PolarHBondContact NZ-OE1 2.89Å
881	K	36.7	Very low	42.5	Very low	188 Å²	188	124 Å²	124	82%	0.817	62%	0.62	S	S	*	*			trans	-128.5	87.4	163.7	-73	-177.2	-179.4	175.3	0	110.9	S883	K881-S883 PolarHBondContact O-N 2.94Å
882	L	43.4	Very low	44	Very low	110 Å²	110	120.6 Å²	120.6	58%	0.576	60%	0.602	S	S	*	*			trans	-57.8	97.5	148.6	-88.4	168.8	0	0	0	106.4	T886 I887	L882-T886 HydrophobicContact CD2-CG2 3.56Å; L882-I887 HydrophobicContact CB-CD1 4.28Å; L882-I887 HydrophobicContact CB-CG1 4.1Å
883	S	46.7	Very low	45.4	Very low	45 Å²	45	122 Å²	122	32%	0.315	60%	0.596	S	S	.	*			trans	-61.7	159	-174.7	76.5	0	0	0	0	110.1	K881 S885 T886 I887	K881-S883 PolarHBondContact O-N 2.94Å; S883-S885 PolarHBondContact O-N 3.46Å; S883-S885 VanDerWaalsContact O-N 3.14Å; S883-S885 PolarHBondContact OG-N 3.47Å; S883-S885 PolarHBondContact OG-OG 3.01Å; S883-T886 PolarHBondContact N-OG1 2.86Å; S883-T886 PolarHBondContact O-N 3.4Å; S883-T886 PolarHBondContact OG-N 2.75Å; S883-T886 PolarHBondContact OG-OG1 2.89Å; S883-I887 PolarHBondContact O-N 3.28Å
884	K	46.4	Very low	46.1	Very low	194 Å²	194	120.4 Å²	120.4	84%	0.843	58%	0.583	S	S	*	*	H	α-helix	trans	-52.7	-35.4	171.2	-82.5	-173.1	174.7	-177.5	0	111.1	Q888	K884-Q888 WeakPolarHBondContact O-CB 3.08Å; K884-Q888 PolarHBondContact O-N 3.39Å
885	S	50.6	Low	47	Very low	87 Å²	87	115.5 Å²	115.5	61%	0.608	57%	0.57	S	S	*	*	H	α-helix	trans	-69.7	-32.5	176.2	77.3	0	0	0	0	113.1	S883 S889	S883-S885 PolarHBondContact O-N 3.46Å; S883-S885 VanDerWaalsContact O-N 3.14Å; S883-S885 PolarHBondContact OG-N 3.47Å; S883-S885 PolarHBondContact OG-OG 3.01Å; S885-S889 WeakPolarHBondContact O-CB 3.44Å; S885-S889 PolarHBondContact O-N 3.1Å
886	T	52.4	Low	48.1	Very low	51 Å²	51	114.2 Å²	114.2	31%	0.313	56%	0.563	S	S	.	*	H	α-helix	trans	-71.3	-45.1	176.8	-39.4	0	0	0	0	111.1	L882 S883 S889 Y890	L882-T886 HydrophobicContact CD2-CG2 3.56Å; S883-T886 PolarHBondContact N-OG1 2.86Å; S883-T886 PolarHBondContact O-N 3.4Å; S883-T886 PolarHBondContact OG-N 2.75Å; S883-T886 PolarHBondContact OG-OG1 2.89Å; T886-S889 WeakPolarHBondContact O-CB 3.49Å; T886-S889 PolarHBondContact O-N 3.44Å; T886-Y890 HydrophobicContact CG2-CD2 4.28Å; T886-Y890 HydrophobicContact CG2-CE2 4.06Å; T886-Y890 VanDerWaalsContact O-CD2 3.26Å; T886-Y890 WeakPolarHBondContact O-CD2 3.42Å; T886-Y890 PolarHBondContact O-N 3Å
887	I	51.6	Low	49.1	Very low	76 Å²	76	109.5 Å²	109.5	39%	0.39	55%	0.545	S	S	.	.	H	α-helix	trans	-64	-43.5	173.9	-61.7	176.4	0	0	0	110	L882 S883 S889 Y890 L891	L882-I887 HydrophobicContact CB-CD1 4.28Å; L882-I887 HydrophobicContact CB-CG1 4.1Å; S883-I887 PolarHBondContact O-N 3.28Å; I887-S889 VanDerWaalsContact C-N 3.31Å; I887-S889 PolarHBondContact O-N 2.94Å; I887-Y890 PolarHBondContact O-N 3.32Å; I887-L891 HydrophobicContact CG2-CD1 4.01Å; I887-L891 HydrophobicContact CG2-CG 4.44Å; I887-L891 WeakPolarHBondContact O-CG 3.26Å; I887-L891 PolarHBondContact O-N 3.28Å
888	Q	57.8	Low	49.9	Very low	98 Å²	98	104.6 Å²	104.6	46%	0.458	52%	0.52	S	S	.	.	H	α-helix	trans	-64	-34.3	175.6	-165.9	64.4	40.3	0	0	112.3	K884 L891 N892	K884-Q888 WeakPolarHBondContact O-CB 3.08Å; K884-Q888 PolarHBondContact O-N 3.39Å; Q888-L891 PolarHBondContact O-N 3.25Å; Q888-N892 PolarHBondContact NE2-OD1 3.03Å; Q888-N892 WeakPolarHBondContact O-CB 3.24Å; Q888-N892 PolarHBondContact O-N 2.95Å; Q888-N892 PolarHBondContact O-OD1 3.49Å
889	S	60.5	Low	51.1	Low	58 Å²	58	100.6 Å²	100.6	41%	0.406	50%	0.504	S	S	.	.	H	α-helix	trans	-65.6	-45.5	173.8	-179.5	0	0	0	0	111.4	S885 T886 I887 L891 N892 N893	S885-S889 WeakPolarHBondContact O-CB 3.44Å; S885-S889 PolarHBondContact O-N 3.1Å; T886-S889 WeakPolarHBondContact O-CB 3.49Å; T886-S889 PolarHBondContact O-N 3.44Å; I887-S889 VanDerWaalsContact C-N 3.31Å; I887-S889 PolarHBondContact O-N 2.94Å; S889-L891 PolarHBondContact O-N 3.45Å; S889-N892 PolarHBondContact O-N 3.03Å; S889-N893 WeakPolarHBondContact O-CB 3.46Å; S889-N893 VanDerWaalsContact O-CG 3.25Å; S889-N893 PolarHBondContact O-N 2.88Å; S889-N893 PolarHBondContact O-ND2 3.16Å
890	Y	52.3	Low	52.2	Low	154 Å²	154	96.7 Å²	96.7	60%	0.604	49%	0.486	S	S	*	.	H	α-helix	trans	-61.7	-42.6	172.7	-81	-67.4	0	0	0	112.4	T886 I887 N893 L894	T886-Y890 HydrophobicContact CG2-CD2 4.28Å; T886-Y890 HydrophobicContact CG2-CE2 4.06Å; T886-Y890 VanDerWaalsContact O-CD2 3.26Å; T886-Y890 WeakPolarHBondContact O-CD2 3.42Å; T886-Y890 PolarHBondContact O-N 3Å; I887-Y890 PolarHBondContact O-N 3.32Å; Y890-N893 PolarHBondContact O-N 3.01Å; Y890-L894 WeakPolarHBondContact O-CB 3.43Å; Y890-L894 VanDerWaalsContact O-CG 3.32Å; Y890-L894 WeakPolarHBondContact O-CG 3.41Å; Y890-L894 PolarHBondContact O-N 3.38Å
891	L	58.3	Low	52.8	Low	84 Å²	84	91.4 Å²	91.4	44%	0.44	46%	0.463	S	S	.	.	H	α-helix	trans	-64.5	-41.8	175.3	-71.7	170.3	0	0	0	112.4	I887 Q888 S889 N893 L894 S895	I887-L891 HydrophobicContact CG2-CD1 4.01Å; I887-L891 HydrophobicContact CG2-CG 4.44Å; I887-L891 WeakPolarHBondContact O-CG 3.26Å; I887-L891 PolarHBondContact O-N 3.28Å; Q888-L891 PolarHBondContact O-N 3.25Å; S889-L891 PolarHBondContact O-N 3.45Å; L891-N893 VanDerWaalsContact C-N 3.32Å; L891-N893 PolarHBondContact O-N 3.3Å; L891-L894 PolarHBondContact O-N 3.36Å; L891-S895 WeakPolarHBondContact O-CB 3.39Å; L891-S895 PolarHBondContact O-N 2.89Å; L891-S895 PolarHBondContact O-OG 2.93Å
892	N	62.8	Low	53.8	Low	71 Å²	71	88.7 Å²	88.7	38%	0.38	45%	0.454	S	S	.	.	H	α-helix	trans	-68	-30	176.5	-73.4	-3.4	0	0	0	112.4	Q888 S889 S895 K896	Q888-N892 PolarHBondContact NE2-OD1 3.03Å; Q888-N892 WeakPolarHBondContact O-CB 3.24Å; Q888-N892 PolarHBondContact O-N 2.95Å; Q888-N892 PolarHBondContact O-OD1 3.49Å; S889-N892 PolarHBondContact O-N 3.03Å; N892-S895 WeakPolarHBondContact CA-OG 3.28Å; N892-S895 PolarHBondContact O-OG 3.38Å; N892-S895 VanDerWaalsContact O-OG 3.13Å; N892-K896 WeakPolarHBondContact O-CD 3.18Å; N892-K896 VanDerWaalsContact O-CG 3.24Å; N892-K896 WeakPolarHBondContact O-CG 3.37Å; N892-K896 PolarHBondContact O-N 3.45Å
893	N	58.9	Low	54.7	Low	88 Å²	88	91.4 Å²	91.4	47%	0.471	46%	0.456	S	S	.	.	H	α-helix	trans	-77.6	-36.4	173.6	-71.9	-29.4	0	0	0	111.6	S889 Y890 L891 K896 W897	S889-N893 WeakPolarHBondContact O-CB 3.46Å; S889-N893 VanDerWaalsContact O-CG 3.25Å; S889-N893 PolarHBondContact O-N 2.88Å; S889-N893 PolarHBondContact O-ND2 3.16Å; Y890-N893 PolarHBondContact O-N 3.01Å; L891-N893 VanDerWaalsContact C-N 3.32Å; L891-N893 PolarHBondContact O-N 3.3Å; N893-K896 PolarHBondContact O-N 2.93Å; N893-W897 PolarHBondContact O-N 3.46Å
894	L	50.1	Low	55.3	Low	73 Å²	73	92.8 Å²	92.8	38%	0.382	46%	0.459	S	S	.	.	H	α-helix	trans	-65.8	-39.6	172	-76.4	164.9	0	0	0	112	Y890 L891 K896 W897 P898	Y890-L894 WeakPolarHBondContact O-CB 3.43Å; Y890-L894 VanDerWaalsContact O-CG 3.32Å; Y890-L894 WeakPolarHBondContact O-CG 3.41Å; Y890-L894 PolarHBondContact O-N 3.38Å; L891-L894 PolarHBondContact O-N 3.36Å; L894-K896 VanDerWaalsContact C-N 3.35Å; L894-K896 PolarHBondContact O-N 2.62Å; L894-W897 WeakPolarHBondContact O-CB 3.31Å; L894-W897 PolarHBondContact O-N 3.07Å; L894-P898 WeakPolarHBondContact O-CD 3.23Å
895	S	52.6	Low	55.7	Low	70 Å²	70	85.4 Å²	85.4	49%	0.49	43%	0.429	S	S	.	.	H	α-helix	trans	-71.5	-26.5	178	67.1	0	0	0	0	113.7	L891 N892 W897	L891-S895 WeakPolarHBondContact O-CB 3.39Å; L891-S895 PolarHBondContact O-N 2.89Å; L891-S895 PolarHBondContact O-OG 2.93Å; N892-S895 WeakPolarHBondContact CA-OG 3.28Å; N892-S895 PolarHBondContact O-OG 3.38Å; N892-S895 VanDerWaalsContact O-OG 3.13Å; S895-W897 VanDerWaalsContact C-N 3.34Å
896	K	57.3	Low	56.4	Low	131 Å²	131	86.8 Å²	86.8	57%	0.57	42%	0.424	S	S	*	.	H	α-helix	trans	-75.4	-20.4	170	-73.2	171.6	-176.5	-179.7	0	113.4	N892 N893 L894 I899 H900	N892-K896 WeakPolarHBondContact O-CD 3.18Å; N892-K896 VanDerWaalsContact O-CG 3.24Å; N892-K896 WeakPolarHBondContact O-CG 3.37Å; N892-K896 PolarHBondContact O-N 3.45Å; N893-K896 PolarHBondContact O-N 2.93Å; L894-K896 VanDerWaalsContact C-N 3.35Å; L894-K896 PolarHBondContact O-N 2.62Å; K896-I899 WeakPolarHBondContact O-CB 3.41Å; K896-I899 PolarHBondContact O-N 2.93Å; K896-H900 PolarHBondContact O-N 3.24Å
897	W	51.7	Low	57	Low	82 Å²	82	88.6 Å²	88.6	31%	0.311	43%	0.432	S	S	.	.	H	α-helix	trans	-65.5	-43.2	-172.9	-144.4	59	0	0	0	113.5	I714 L715 N893 L894 S895 I899 H900 C901	I714-W897 HydrophobicContact CB-CH2 4.17Å; I714-W897 HydrophobicContact CB-CZ3 3.99Å; I714-W897 HydrophobicContact CD1-CZ3 3.97Å; I714-W897 HydrophobicContact CG2-CH2 3.73Å; I714-W897 HydrophobicContact CG2-CZ3 3.54Å; L715-W897 HydrophobicContact CD2-CH2 4.42Å; L715-W897 HydrophobicContact CD2-CZ2 4.28Å; N893-W897 PolarHBondContact O-N 3.46Å; L894-W897 WeakPolarHBondContact O-CB 3.31Å; L894-W897 PolarHBondContact O-N 3.07Å; S895-W897 VanDerWaalsContact C-N 3.34Å; W897-I899 VanDerWaalsContact C-N 3.33Å; W897-I899 PolarHBondContact O-N 3.3Å; W897-H900 PolarHBondContact O-N 2.89Å; W897-H900 VanDerWaalsContact O-N 3.13Å; W897-C901 PolarHBondContact O-N 3.42Å; W897-C901 PolarHBondContact O-SG 2.9Å; W897-C901 VanDerWaalsContact O-SG 3.41Å
898	P	52.7	Low	57.3	Low	33 Å²	33	87.9 Å²	87.9	21%	0.214	43%	0.428	C	S	.	.	H	α-helix	trans	-54.5	-44.1	170.2	-28.1	35.5	0	0	0	113.5	L894 H900 C901 E902	L894-P898 WeakPolarHBondContact O-CD 3.23Å; P898-H900 VanDerWaalsContact C-N 3.28Å; P898-H900 PolarHBondContact O-N 2.82Å; P898-C901 PolarHBondContact O-N 3.2Å; P898-E902 WeakPolarHBondContact O-CB 3.46Å; P898-E902 PolarHBondContact O-N 2.85Å
899	I	59	Low	57.4	Low	92 Å²	92	86.9 Å²	86.9	47%	0.472	43%	0.429	S	S	.	.	H	α-helix	trans	-63.2	-37.4	178.7	-55.3	173.6	0	0	0	110.6	K896 W897 E902 R903	K896-I899 WeakPolarHBondContact O-CB 3.41Å; K896-I899 PolarHBondContact O-N 2.93Å; W897-I899 VanDerWaalsContact C-N 3.33Å; W897-I899 PolarHBondContact O-N 3.3Å; I899-E902 PolarHBondContact O-N 3.09Å; I899-R903 WeakPolarHBondContact O-CG 3.49Å; I899-R903 PolarHBondContact O-N 3.27Å
900	H	56.4	Low	57.7	Low	112 Å²	112	88.8 Å²	88.8	52%	0.519	43%	0.432	S	S	.	.	H	α-helix	trans	-72.5	-39.9	178.9	-156.5	16.4	0	0	0	112.2	K896 W897 P898 E902 R903 L904	K896-H900 PolarHBondContact O-N 3.24Å; W897-H900 PolarHBondContact O-N 2.89Å; W897-H900 VanDerWaalsContact O-N 3.13Å; P898-H900 VanDerWaalsContact C-N 3.28Å; P898-H900 PolarHBondContact O-N 2.82Å; H900-E902 VanDerWaalsContact C-N 3.33Å; H900-R903 PolarHBondContact O-N 3.38Å; H900-L904 WeakPolarHBondContact O-CG 3.41Å; H900-L904 PolarHBondContact O-N 2.96Å
901	C	50.4	Low	58.3	Low	22 Å²	22	85.5 Å²	85.5	15%	0.149	42%	0.422	C	S	.	.	H	α-helix	trans	-62.4	-38.7	170.5	-67.4	0	0	0	0	112.1	W897 P898 L904 L905	W897-C901 PolarHBondContact O-N 3.42Å; W897-C901 PolarHBondContact O-SG 2.9Å; W897-C901 VanDerWaalsContact O-SG 3.41Å; P898-C901 PolarHBondContact O-N 3.2Å; C901-L904 PolarHBondContact O-N 3.28Å; C901-L905 WeakPolarHBondContact O-CB 3.49Å; C901-L905 VanDerWaalsContact O-CG 3.3Å; C901-L905 WeakPolarHBondContact O-CG 3.36Å; C901-L905 PolarHBondContact O-N 2.92Å
902	E	57.2	Low	58.2	Low	132 Å²	132	85.1 Å²	85.1	62%	0.617	42%	0.417	S	S	*	.	H	α-helix	trans	-69.3	-37.8	178.6	-168.6	166.7	-136.1	0	0	112.2	P898 I899 H900 L905 K906	P898-E902 WeakPolarHBondContact O-CB 3.46Å; P898-E902 PolarHBondContact O-N 2.85Å; I899-E902 PolarHBondContact O-N 3.09Å; H900-E902 VanDerWaalsContact C-N 3.33Å; E902-L905 PolarHBondContact O-N 3.33Å; E902-K906 WeakPolarHBondContact O-CB 3.38Å; E902-K906 PolarHBondContact O-N 3.47Å
903	R	63.6	Low	58.1	Low	167 Å²	167	84.5 Å²	84.5	63%	0.63	42%	0.418	S	S	*	.	H	α-helix	trans	-61.7	-52.3	168.3	-75.3	-176.9	-178.8	-179.4	-0.8	111.9	I899 H900 L905 K906 D907	I899-R903 WeakPolarHBondContact O-CG 3.49Å; I899-R903 PolarHBondContact O-N 3.27Å; H900-R903 PolarHBondContact O-N 3.38Å; R903-L905 VanDerWaalsContact C-N 3.25Å; R903-L905 PolarHBondContact O-N 3.42Å; R903-K906 CarbonylContact O-C 3.58Å; R903-K906 WeakPolarHBondContact O-CA 3.46Å; R903-K906 WeakPolarHBondContact O-CB 3.43Å; R903-K906 PolarHBondContact O-N 3.21Å; R903-D907 PolarHBondContact O-N 2.91Å
904	L	57.7	Low	58.4	Low	73 Å²	73	86.6 Å²	86.6	38%	0.382	43%	0.427	S	S	.	.	H	α-helix	trans	-57.8	-37.6	178	-76.7	166.6	0	0	0	112.6	F718 H900 C901 L908	F718-L904 HydrophobicContact CZ-CD1 4.46Å; H900-L904 WeakPolarHBondContact O-CG 3.41Å; H900-L904 PolarHBondContact O-N 2.96Å; C901-L904 PolarHBondContact O-N 3.28Å; L904-L908 WeakPolarHBondContact O-CB 3.2Å; L904-L908 PolarHBondContact O-N 2.8Å
905	L	56.1	Low	58.9	Low	39 Å²	39	86.4 Å²	86.4	20%	0.204	42%	0.423	C	S	.	.	H	α-helix	trans	-66.3	-41.1	173.1	-80.2	165.6	0	0	0	112.1	I774 C901 E902 R903 T909	I774-L905 HydrophobicContact CG1-CD2 4.14Å; I774-L905 HydrophobicContact CG2-CD2 4.36Å; C901-L905 WeakPolarHBondContact O-CB 3.49Å; C901-L905 VanDerWaalsContact O-CG 3.3Å; C901-L905 WeakPolarHBondContact O-CG 3.36Å; C901-L905 PolarHBondContact O-N 2.92Å; E902-L905 PolarHBondContact O-N 3.33Å; R903-L905 VanDerWaalsContact C-N 3.25Å; R903-L905 PolarHBondContact O-N 3.42Å; L905-T909 WeakPolarHBondContact O-CB 3.49Å; L905-T909 PolarHBondContact O-N 2.84Å; L905-T909 PolarHBondContact O-OG1 3.44Å
906	K	64.4	Low	59.2	Low	116 Å²	116	85.7 Å²	85.7	50%	0.504	41%	0.413	S	S	.	.	H	α-helix	trans	-64.7	-46.4	176.3	-175.2	172.7	-179.3	-77.6	0	111.3	E902 R903 L908 T909 E910	E902-K906 WeakPolarHBondContact O-CB 3.38Å; E902-K906 PolarHBondContact O-N 3.47Å; R903-K906 CarbonylContact O-C 3.58Å; R903-K906 WeakPolarHBondContact O-CA 3.46Å; R903-K906 WeakPolarHBondContact O-CB 3.43Å; R903-K906 PolarHBondContact O-N 3.21Å; K906-L908 PolarHBondContact O-N 3.12Å; K906-T909 WeakPolarHBondContact O-CB 3.46Å; K906-T909 PolarHBondContact O-N 3.49Å; K906-E910 WeakPolarHBondContact CE-OE1 3.32Å; K906-E910 IonicContact NZ-OE1 2.72Å; K906-E910 PolarHBondContact NZ-OE1 3Å; K906-E910 IonicContact NZ-OE2 2.68Å; K906-E910 PolarHBondContact O-N 3.16Å
907	D	66.5	Low	59.5	Low	89 Å²	89	83.4 Å²	83.4	48%	0.476	41%	0.407	S	S	.	.	H	α-helix	trans	-60.4	-45.2	177.6	-56.6	-20.5	0	0	0	110.5	R903 T909 E910 E911	R903-D907 PolarHBondContact O-N 2.91Å; D907-T909 VanDerWaalsContact C-N 3.29Å; D907-T909 PolarHBondContact O-N 3.29Å; D907-E910 PolarHBondContact O-N 2.95Å; D907-E911 WeakPolarHBondContact O-CB 3.25Å; D907-E911 PolarHBondContact O-N 3.26Å
908	L	57	Low	60.1	Low	61 Å²	61	84.2 Å²	84.2	32%	0.319	42%	0.417	S	S	.	.	H	α-helix	trans	-60.6	-37.2	173.3	-123.4	89.9	0	0	0	112.6	L904 K906 F912	L904-L908 WeakPolarHBondContact O-CB 3.2Å; L904-L908 PolarHBondContact O-N 2.8Å; K906-L908 PolarHBondContact O-N 3.12Å; L908-F912 WeakPolarHBondContact O-CB 3.26Å; L908-F912 PolarHBondContact O-N 3.18Å
909	T	60.5	Low	60.3	Low	77 Å²	77	84.4 Å²	84.4	47%	0.472	42%	0.417	S	S	.	.	H	α-helix	trans	-73.7	-38.3	-178.6	-54.6	0	0	0	0	111.1	L905 K906 D907 S913	L905-T909 WeakPolarHBondContact O-CB 3.49Å; L905-T909 PolarHBondContact O-N 2.84Å; L905-T909 PolarHBondContact O-OG1 3.44Å; K906-T909 WeakPolarHBondContact O-CB 3.46Å; K906-T909 PolarHBondContact O-N 3.49Å; D907-T909 VanDerWaalsContact C-N 3.29Å; D907-T909 PolarHBondContact O-N 3.29Å; T909-S913 VanDerWaalsContact O-CB 3.22Å; T909-S913 WeakPolarHBondContact O-CB 3.26Å; T909-S913 PolarHBondContact O-N 2.89Å
910	E	66.2	Low	60.5	Low	98 Å²	98	84 Å²	84	46%	0.458	41%	0.414	S	S	.	.	H	α-helix	trans	-67.8	-44.3	173.9	-77.1	178	178.8	0	0	111.4	K906 D907 F912 S913 M914	K906-E910 WeakPolarHBondContact CE-OE1 3.32Å; K906-E910 IonicContact NZ-OE1 2.72Å; K906-E910 PolarHBondContact NZ-OE1 3Å; K906-E910 IonicContact NZ-OE2 2.68Å; K906-E910 PolarHBondContact O-N 3.16Å; D907-E910 PolarHBondContact O-N 2.95Å; E910-F912 PolarHBondContact O-N 3.46Å; E910-S913 PolarHBondContact O-N 3.37Å; E910-M914 PolarHBondContact O-N 3.43Å
911	E	64	Low	60.7	Low	85 Å²	85	83.2 Å²	83.2	40%	0.397	41%	0.414	S	S	.	.	H	α-helix	trans	-62.7	-42.5	175.6	-165.4	-165.9	156.2	0	0	111.8	D907 M914 K915	D907-E911 WeakPolarHBondContact O-CB 3.25Å; D907-E911 PolarHBondContact O-N 3.26Å; E911-M914 PolarHBondContact O-N 2.95Å; E911-K915 HydrophobicContact CG-CD 4.5Å; E911-K915 PolarHBondContact O-N 2.97Å; E911-K915 VanDerWaalsContact O-N 3.1Å; E911-K915 WeakPolarHBondContact OE1-CE 3.34Å; E911-K915 IonicContact OE1-NZ 3.39Å; E911-K915 PolarHBondContact OE1-NZ 3.2Å
912	F	57.6	Low	61	Low	77 Å²	77	86.1 Å²	86.1	34%	0.338	43%	0.427	S	S	.	.	H	α-helix	trans	-64.8	-40.5	175.3	-167.4	-80.1	0	0	0	111.6	L767 L908 E910 K915 L916	L767-F912 HydrophobicContact CD2-CE1 3.57Å; L767-F912 HydrophobicContact CD2-CZ 3.82Å; L767-F912 HydrophobicContact CG-CE1 4.13Å; L767-F912 HydrophobicContact CG-CZ 3.96Å; L908-F912 WeakPolarHBondContact O-CB 3.26Å; L908-F912 PolarHBondContact O-N 3.18Å; E910-F912 PolarHBondContact O-N 3.46Å; F912-K915 PolarHBondContact O-N 3.36Å; F912-L916 HydrophobicContact CE1-CD1 4.21Å; F912-L916 WeakPolarHBondContact O-CB 3.5Å; F912-L916 PolarHBondContact O-N 3.28Å
913	S	61	Low	61	Low	58 Å²	58	82.1 Å²	82.1	41%	0.406	41%	0.412	S	S	.	.	H	α-helix	trans	-64.6	-42	177.2	-170.9	0	0	0	0	112.3	T909 E910 L916 N917	T909-S913 VanDerWaalsContact O-CB 3.22Å; T909-S913 WeakPolarHBondContact O-CB 3.26Å; T909-S913 PolarHBondContact O-N 2.89Å; E910-S913 PolarHBondContact O-N 3.37Å; S913-L916 PolarHBondContact O-N 2.78Å; S913-N917 PolarHBondContact O-N 3.36Å; S913-N917 PolarHBondContact O-ND2 2.95Å
914	M	64.4	Low	60.7	Low	132 Å²	132	77 Å²	77	65%	0.65	40%	0.402	S	S	*	.	H	α-helix	trans	-59.6	-50.1	173.3	-76.4	-174.6	170	0	0	111.4	E910 E911 L916 N917 D918	E910-M914 PolarHBondContact O-N 3.43Å; E911-M914 PolarHBondContact O-N 2.95Å; M914-L916 VanDerWaalsContact C-N 3.27Å; M914-L916 PolarHBondContact O-N 3.05Å; M914-N917 PolarHBondContact O-N 3.31Å; M914-N917 VanDerWaalsContact O-N 3.13Å; M914-D918 PolarHBondContact O-N 3.27Å
915	K	60.3	Low	60.7	Low	68 Å²	68	78.8 Å²	78.8	30%	0.296	41%	0.41	S	S	.	.	H	α-helix	trans	-65	-28.6	178.5	-72.9	172.5	174.4	171.7	0	113.3	M729 E911 F912 L919	M729-K915 PolarHBondContact SD-NZ 2.94Å; E911-K915 HydrophobicContact CG-CD 4.5Å; E911-K915 PolarHBondContact O-N 2.97Å; E911-K915 VanDerWaalsContact O-N 3.1Å; E911-K915 WeakPolarHBondContact OE1-CE 3.34Å; E911-K915 IonicContact OE1-NZ 3.39Å; E911-K915 PolarHBondContact OE1-NZ 3.2Å; F912-K915 PolarHBondContact O-N 3.36Å; K915-L919 PolarHBondContact O-N 3.23Å
916	L	60	Low	60.3	Low	55 Å²	55	80.6 Å²	80.6	29%	0.288	42%	0.417	S	S	.	.	H	α-helix	trans	-71.7	-40.3	172.9	-164.6	79.1	0	0	0	111.2	L767 F912 S913 M914 L919 I920	L767-L916 HydrophobicContact CD1-CD1 4.42Å; F912-L916 HydrophobicContact CE1-CD1 4.21Å; F912-L916 WeakPolarHBondContact O-CB 3.5Å; F912-L916 PolarHBondContact O-N 3.28Å; S913-L916 PolarHBondContact O-N 2.78Å; M914-L916 VanDerWaalsContact C-N 3.27Å; M914-L916 PolarHBondContact O-N 3.05Å; L916-L919 WeakPolarHBondContact O-CB 3.4Å; L916-L919 PolarHBondContact O-N 3.11Å; L916-I920 HydrophobicContact CD2-CD1 4.49Å; L916-I920 HydrophobicContact CG-CD1 4.28Å; L916-I920 VanDerWaalsContact O-CG1 3.31Å; L916-I920 WeakPolarHBondContact O-CG1 3.35Å; L916-I920 PolarHBondContact O-N 2.95Å
917	N	63.8	Low	59.6	Low	83 Å²	83	83 Å²	83	44%	0.444	43%	0.427	S	S	.	.	H	α-helix	trans	-65.4	-44.9	174.7	-70.3	-21.1	0	0	0	111.6	S913 M914 L919 I920 D921	S913-N917 PolarHBondContact O-N 3.36Å; S913-N917 PolarHBondContact O-ND2 2.95Å; M914-N917 PolarHBondContact O-N 3.31Å; M914-N917 VanDerWaalsContact O-N 3.13Å; N917-L919 PolarHBondContact O-N 3.42Å; N917-I920 PolarHBondContact O-N 3.01Å; N917-D921 PolarHBondContact O-N 3.31Å
918	D	63.5	Low	58.6	Low	99 Å²	99	84.2 Å²	84.2	53%	0.529	44%	0.441	S	S	.	.	H	α-helix	trans	-52.8	-40.2	172.6	-71.7	-16.1	0	0	0	111.4	M914 I922	M914-D918 PolarHBondContact O-N 3.27Å; D918-I922 WeakPolarHBondContact O-CD1 3.45Å; D918-I922 VanDerWaalsContact O-CG1 3.24Å; D918-I922 WeakPolarHBondContact O-CG1 3.41Å; D918-I922 PolarHBondContact O-N 3.14Å; D918-I922 VanDerWaalsContact O-N 3.09Å
919	L	57.8	Low	57.7	Low	38 Å²	38	92.6 Å²	92.6	20%	0.199	48%	0.476	C	S	.	.	H	α-helix	trans	-71.5	-42.3	177.9	-170.4	79.2	0	0	0	112.4	F759 L763 K915 L916 N917 D921 I922 V923	F759-L919 HydrophobicContact CE1-CD1 3.94Å; F759-L919 HydrophobicContact CE1-CD2 4.05Å; F759-L919 HydrophobicContact CE1-CG 4.4Å; F759-L919 HydrophobicContact CZ-CD1 3.63Å; F759-L919 HydrophobicContact CZ-CD2 3.62Å; F759-L919 HydrophobicContact CZ-CG 4.18Å; L763-L919 HydrophobicContact CD1-CD2 3.36Å; K915-L919 PolarHBondContact O-N 3.23Å; L916-L919 WeakPolarHBondContact O-CB 3.4Å; L916-L919 PolarHBondContact O-N 3.11Å; N917-L919 PolarHBondContact O-N 3.42Å; L919-D921 VanDerWaalsContact C-N 3.31Å; L919-D921 PolarHBondContact O-N 3.26Å; L919-I922 PolarHBondContact O-N 3.22Å; L919-V923 WeakPolarHBondContact O-CG2 3.37Å; L919-V923 PolarHBondContact O-N 3.14Å
920	I	61.9	Low	57.5	Low	83 Å²	83	93.4 Å²	93.4	43%	0.426	48%	0.476	S	S	.	.	H	α-helix	trans	-59.2	-44.9	174.9	-71.3	163.9	0	0	0	109.6	L916 N917 I922 V923 S924	L916-I920 HydrophobicContact CD2-CD1 4.49Å; L916-I920 HydrophobicContact CG-CD1 4.28Å; L916-I920 VanDerWaalsContact O-CG1 3.31Å; L916-I920 WeakPolarHBondContact O-CG1 3.35Å; L916-I920 PolarHBondContact O-N 2.95Å; N917-I920 PolarHBondContact O-N 3.01Å; I920-I922 PolarHBondContact O-N 3.04Å; I920-V923 CarbonylContact O-C 3.49Å; I920-V923 PolarHBondContact O-N 3.11Å; I920-V923 VanDerWaalsContact O-N 3.16Å; I920-S924 WeakPolarHBondContact O-CB 3.3Å; I920-S924 PolarHBondContact O-N 3.09Å; I920-S924 PolarHBondContact O-OG 3.32Å
921	D	60.2	Low	57.1	Low	95 Å²	95	93.2 Å²	93.2	51%	0.508	48%	0.477	S	S	.	.	H	α-helix	trans	-61.1	-43.3	176.6	-76.5	-16.7	0	0	0	111.9	N917 L919 V923 S924 I925	N917-D921 PolarHBondContact O-N 3.31Å; L919-D921 VanDerWaalsContact C-N 3.31Å; L919-D921 PolarHBondContact O-N 3.26Å; D921-V923 VanDerWaalsContact C-N 3.33Å; D921-V923 PolarHBondContact O-N 2.89Å; D921-S924 PolarHBondContact O-N 3.26Å; D921-I925 WeakPolarHBondContact O-CB 3.41Å; D921-I925 WeakPolarHBondContact O-CD1 3.42Å; D921-I925 WeakPolarHBondContact O-CG1 3.5Å; D921-I925 PolarHBondContact O-N 3.06Å
922	I	58.2	Low	56.7	Low	84 Å²	84	93.6 Å²	93.6	43%	0.431	48%	0.481	S	S	.	.	H	α-helix	trans	-59.4	-43.4	174	-71.1	163.7	0	0	0	111.3	D918 L919 I920 F926	D918-I922 WeakPolarHBondContact O-CD1 3.45Å; D918-I922 VanDerWaalsContact O-CG1 3.24Å; D918-I922 WeakPolarHBondContact O-CG1 3.41Å; D918-I922 PolarHBondContact O-N 3.14Å; D918-I922 VanDerWaalsContact O-N 3.09Å; L919-I922 PolarHBondContact O-N 3.22Å; I920-I922 PolarHBondContact O-N 3.04Å; I922-F926 PolarHBondContact O-N 3Å
923	V	56.8	Low	56.6	Low	48 Å²	48	94.6 Å²	94.6	29%	0.291	49%	0.49	S	S	.	.	H	α-helix	trans	-68.8	-42.5	178.4	172.1	0	0	0	0	111.2	L919 I920 D921 F926 F927	L919-V923 WeakPolarHBondContact O-CG2 3.37Å; L919-V923 PolarHBondContact O-N 3.14Å; I920-V923 CarbonylContact O-C 3.49Å; I920-V923 PolarHBondContact O-N 3.11Å; I920-V923 VanDerWaalsContact O-N 3.16Å; D921-V923 VanDerWaalsContact C-N 3.33Å; D921-V923 PolarHBondContact O-N 2.89Å; V923-F926 CarbonylContact O-C 3.6Å; V923-F926 WeakPolarHBondContact O-CA 3.34Å; V923-F926 VanDerWaalsContact O-CB 3.31Å; V923-F926 WeakPolarHBondContact O-CB 3.31Å; V923-F926 PolarHBondContact O-N 3.43Å; V923-F927 HydrophobicContact CG1-CD2 3.89Å; V923-F927 HydrophobicContact CG1-CE2 4.08Å; V923-F927 PolarHBondContact O-N 3.1Å
924	S	57.4	Low	56.4	Low	60 Å²	60	96.9 Å²	96.9	42%	0.42	50%	0.495	S	S	.	.	H	α-helix	trans	-64.2	-41.1	177.1	-72.9	0	0	0	0	112.4	I920 D921 F926 F927 C928	I920-S924 WeakPolarHBondContact O-CB 3.3Å; I920-S924 PolarHBondContact O-N 3.09Å; I920-S924 PolarHBondContact O-OG 3.32Å; D921-S924 PolarHBondContact O-N 3.26Å; S924-F926 PolarHBondContact O-N 3.02Å; S924-F927 PolarHBondContact O-N 3.01Å; S924-C928 WeakPolarHBondContact O-CB 3.42Å; S924-C928 PolarHBondContact O-N 3.08Å
925	I	58.1	Low	55.8	Low	110 Å²	110	94.5 Å²	94.5	56%	0.564	48%	0.484	S	S	*	.	H	α-helix	trans	-60.1	-31	172.1	-70	164.1	0	0	0	111.3	D921	D921-I925 WeakPolarHBondContact O-CB 3.41Å; D921-I925 WeakPolarHBondContact O-CD1 3.42Å; D921-I925 WeakPolarHBondContact O-CG1 3.5Å; D921-I925 PolarHBondContact O-N 3.06Å
926	F	47	Very low	55.5	Low	77 Å²	77	96.4 Å²	96.4	34%	0.338	50%	0.498	S	S	.	.	H	α-helix	trans	-79.6	-25.5	178.6	-123.4	-86.6	0	0	0	114.5	F739 I922 V923 S924	F739-F926 HydrophobicContact CE1-CD2 4.38Å; F739-F926 AromaticContact CE1-CE2 3.92Å; F739-F926 HydrophobicContact CE1-CE2 3.92Å; F739-F926 HydrophobicContact CE1-CZ 4.3Å; I922-F926 PolarHBondContact O-N 3Å; V923-F926 CarbonylContact O-C 3.6Å; V923-F926 WeakPolarHBondContact O-CA 3.34Å; V923-F926 VanDerWaalsContact O-CB 3.31Å; V923-F926 WeakPolarHBondContact O-CB 3.31Å; V923-F926 PolarHBondContact O-N 3.43Å; S924-F926 PolarHBondContact O-N 3.02Å
927	F	49	Very low	55.2	Low	166 Å²	166	99.6 Å²	99.6	73%	0.728	51%	0.514	S	S	*	.	H	α-helix	trans	-94.4	-14.6	176.1	-87.6	-80.6	0	0	0	113.7	V923 S924	V923-F927 HydrophobicContact CG1-CD2 3.89Å; V923-F927 HydrophobicContact CG1-CE2 4.08Å; V923-F927 PolarHBondContact O-N 3.1Å; S924-F927 PolarHBondContact O-N 3.01Å
928	C	46.1	Very low	54.5	Low	114 Å²	114	101 Å²	101	77%	0.77	52%	0.52	S	S	*	.			trans	-99.2	15.1	175.8	-66.1	0	0	0	0	114.1	S924	S924-C928 WeakPolarHBondContact O-CB 3.42Å; S924-C928 PolarHBondContact O-N 3.08Å
929	K	37.6	Very low	53.6	Low	238 Å²	238	101.2 Å²	101.2	100%	1.035	52%	0.519	S	S	*	.			trans	-135.8	0	172.3	-85	-173.5	174.6	177.1	0	111.2

Retrieved 929 of 929 residues in 1215 ms (Link to these results)

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